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Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.
Benzene and substituted derivatives (64,917)
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Phenol esters (426)
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1-hydroxylamino 2-unsubstituted benzenoids (5)

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5,356 – 5,370 of 73,799 results
5,356

2-Amino-5-chlorobenzoic acid, 98%

CAS: 635-21-2 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00007838 InChI Key: IFXKXCLVKQVVDI-UHFFFAOYSA-N Synonym: 5-chloroanthranilic acid,5-chloro-2-aminobenzoic acid,benzoic acid, 2-amino-5-chloro,anthranilic acid, 5-chloro,2-amino-5-chloro-benzoic acid,unii-z2y66jmi31,2-carboxy-4-chloroaniline,chembl36767,5-amino-3-carboxy-1-chlorobenzene,2-amino-5-chlorobenzoicacid PubChem CID: 12476 IUPAC Name: 2-amino-5-chlorobenzoic acid SMILES: C1=CC(=C(C=C1Cl)C(=O)O)N

PubChem CID 12476
CAS 635-21-2
Molecular Weight (g/mol) 171.58
MDL Number MFCD00007838
SMILES C1=CC(=C(C=C1Cl)C(=O)O)N
Synonym 5-chloroanthranilic acid,5-chloro-2-aminobenzoic acid,benzoic acid, 2-amino-5-chloro,anthranilic acid, 5-chloro,2-amino-5-chloro-benzoic acid,unii-z2y66jmi31,2-carboxy-4-chloroaniline,chembl36767,5-amino-3-carboxy-1-chlorobenzene,2-amino-5-chlorobenzoicacid
IUPAC Name 2-amino-5-chlorobenzoic acid
InChI Key IFXKXCLVKQVVDI-UHFFFAOYSA-N
Molecular Formula C7H6ClNO2
5,357

Methyl 3,5-di-tert-butyl-4-hydroxybenzoate, 98%

CAS: 2511-22-0 Molecular Formula: C16H24O3 Molecular Weight (g/mol): 264.37 MDL Number: MFCD00017253 InChI Key: UPVYFJALDJUSOV-UHFFFAOYSA-N Synonym: methyl 3,5-di-tert-butyl-4-hydroxybenzoate,benzoic acid, 3,5-bis 1,1-dimethylethyl-4-hydroxy-, methyl ester,3,5-di-tert-butyl-4-hydroxybenzoic acid methyl ester,3,5-bis 1,1-dimethylethyl-4-hydroxy-benzoic acid ethyl ester,acmc-20akhp,methyl 3,5-bis-tert-butyl-4-hydroxybenzoate,benzoic acid, 3,5-di-tert-butyl-4-hydroxy-, methyl ester,methyl 3,5-di-tert.butyl-4-hydroxylbenzoate,methyl 3,5-bis tert-butyl-4-hydroxybenzoate PubChem CID: 75639 IUPAC Name: methyl 3,5-ditert-butyl-4-hydroxybenzoate SMILES: COC(=O)C1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C

PubChem CID 75639
CAS 2511-22-0
Molecular Weight (g/mol) 264.37
MDL Number MFCD00017253
SMILES COC(=O)C1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C
Synonym methyl 3,5-di-tert-butyl-4-hydroxybenzoate,benzoic acid, 3,5-bis 1,1-dimethylethyl-4-hydroxy-, methyl ester,3,5-di-tert-butyl-4-hydroxybenzoic acid methyl ester,3,5-bis 1,1-dimethylethyl-4-hydroxy-benzoic acid ethyl ester,acmc-20akhp,methyl 3,5-bis-tert-butyl-4-hydroxybenzoate,benzoic acid, 3,5-di-tert-butyl-4-hydroxy-, methyl ester,methyl 3,5-di-tert.butyl-4-hydroxylbenzoate,methyl 3,5-bis tert-butyl-4-hydroxybenzoate
IUPAC Name methyl 3,5-ditert-butyl-4-hydroxybenzoate
InChI Key UPVYFJALDJUSOV-UHFFFAOYSA-N
Molecular Formula C16H24O3
5,358

3,4-Dihydroxyphenylacetic acid, 98+%

CAS: 102-32-9 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.148 MDL Number: MFCD00004338 InChI Key: CFFZDZCDUFSOFZ-UHFFFAOYSA-N Synonym: 3,4-dihydroxyphenylacetic acid,dopac,homoprotocatechuic acid,2-3,4-dihydroxyphenyl acetic acid,dopacetic acid,benzeneacetic acid, 3,4-dihydroxy,dihydroxyphenylacetic acid,3,4-dihydroxybenzeneacetic acid,4-carboxymethylcatechol,homoprotocatechuate PubChem CID: 547 ChEBI: CHEBI:41941 IUPAC Name: 2-(3,4-dihydroxyphenyl)acetic acid SMILES: C1=CC(=C(C=C1CC(=O)O)O)O

PubChem CID 547
CAS 102-32-9
Molecular Weight (g/mol) 168.148
ChEBI CHEBI:41941
MDL Number MFCD00004338
SMILES C1=CC(=C(C=C1CC(=O)O)O)O
Synonym 3,4-dihydroxyphenylacetic acid,dopac,homoprotocatechuic acid,2-3,4-dihydroxyphenyl acetic acid,dopacetic acid,benzeneacetic acid, 3,4-dihydroxy,dihydroxyphenylacetic acid,3,4-dihydroxybenzeneacetic acid,4-carboxymethylcatechol,homoprotocatechuate
IUPAC Name 2-(3,4-dihydroxyphenyl)acetic acid
InChI Key CFFZDZCDUFSOFZ-UHFFFAOYSA-N
Molecular Formula C8H8O4
5,359

3-Bromoanisole, 98+%

CAS: 2398-37-0 Molecular Formula: C7H7BrO Molecular Weight (g/mol): 187.04 MDL Number: MFCD00000081 InChI Key: PLDWAJLZAAHOGG-UHFFFAOYSA-N Synonym: 3-bromoanisole,m-bromoanisole,3-methoxybromobenzene,3-bromo anisole,m-bromomethoxybenzene,benzene, 1-bromo-3-methoxy,anisole, m-bromo,3-methoxy-1-bromobenzene,m-methoxybromobenzene,meta-bromoanisole PubChem CID: 16971 IUPAC Name: 1-bromo-3-methoxybenzene SMILES: COC1=CC=CC(Br)=C1

PubChem CID 16971
CAS 2398-37-0
Molecular Weight (g/mol) 187.04
MDL Number MFCD00000081
SMILES COC1=CC=CC(Br)=C1
Synonym 3-bromoanisole,m-bromoanisole,3-methoxybromobenzene,3-bromo anisole,m-bromomethoxybenzene,benzene, 1-bromo-3-methoxy,anisole, m-bromo,3-methoxy-1-bromobenzene,m-methoxybromobenzene,meta-bromoanisole
IUPAC Name 1-bromo-3-methoxybenzene
InChI Key PLDWAJLZAAHOGG-UHFFFAOYSA-N
Molecular Formula C7H7BrO
5,360

2-Chlorophenylacetone, 96%

CAS: 6305-95-9 Molecular Formula: C9H9ClO Molecular Weight (g/mol): 168.62 MDL Number: MFCD00045175 InChI Key: LWGNDIMNCPMZOF-UHFFFAOYSA-N Synonym: 2-chlorophenylacetone,1-2-chlorophenyl propan-2-one,1-2-chlorophenyl acetone,2-propanone, 1-2-chlorophenyl,acmc-20apcv,2-chlorphenyl acetone,1-2-chlorophenyl acetone #,1-2-chlorophenyl-2-propanone,1-2-chloro-phenyl-propan-2-one PubChem CID: 229355 IUPAC Name: 1-(2-chlorophenyl)propan-2-one SMILES: CC(=O)CC1=CC=CC=C1Cl

PubChem CID 229355
CAS 6305-95-9
Molecular Weight (g/mol) 168.62
MDL Number MFCD00045175
SMILES CC(=O)CC1=CC=CC=C1Cl
Synonym 2-chlorophenylacetone,1-2-chlorophenyl propan-2-one,1-2-chlorophenyl acetone,2-propanone, 1-2-chlorophenyl,acmc-20apcv,2-chlorphenyl acetone,1-2-chlorophenyl acetone #,1-2-chlorophenyl-2-propanone,1-2-chloro-phenyl-propan-2-one
IUPAC Name 1-(2-chlorophenyl)propan-2-one
InChI Key LWGNDIMNCPMZOF-UHFFFAOYSA-N
Molecular Formula C9H9ClO
5,361

Benzyl Alcohol, NF, EP, bioCERTIFIED, 98-100.5%, Spectrum™ Chemical
SDP

CAS: 100-51-6 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00004599,MFCD03792087 InChI Key: WVDDGKGOMKODPV-UHFFFAOYSA-N IUPAC Name: phenylmethanol SMILES: OCC1=CC=CC=C1

CAS 100-51-6
Molecular Weight (g/mol) 108.14
MDL Number MFCD00004599,MFCD03792087
SMILES OCC1=CC=CC=C1
IUPAC Name phenylmethanol
InChI Key WVDDGKGOMKODPV-UHFFFAOYSA-N
Molecular Formula C7H8O
5,362

4-Bromo-2-nitrophenol, 98%, Thermo Scientific™

CAS: 7693-52-9 Molecular Formula: C6H4BrNO3 Molecular Weight (g/mol): 218.01 MDL Number: MFCD00082540 InChI Key: CUTFAPGINUFNQM-UHFFFAOYSA-N Synonym: 2-nitro-4-bromophenol,phenol, 4-bromo-2-nitro,4-bromo-2-nitro-phenol,4-bromo-1-hydroxy-2-nitrobenzene,phenol, 2-nitro-5-bromo,pubchem4099,4-brom-2-nitro-phenol,acmc-209p6y,4-06-00-01363 beilstein handbook reference,ksc494e2j PubChem CID: 24364 IUPAC Name: 4-bromo-2-nitrophenol SMILES: OC1=CC=C(Br)C=C1[N+]([O-])=O

PubChem CID 24364
CAS 7693-52-9
Molecular Weight (g/mol) 218.01
MDL Number MFCD00082540
SMILES OC1=CC=C(Br)C=C1[N+]([O-])=O
Synonym 2-nitro-4-bromophenol,phenol, 4-bromo-2-nitro,4-bromo-2-nitro-phenol,4-bromo-1-hydroxy-2-nitrobenzene,phenol, 2-nitro-5-bromo,pubchem4099,4-brom-2-nitro-phenol,acmc-209p6y,4-06-00-01363 beilstein handbook reference,ksc494e2j
IUPAC Name 4-bromo-2-nitrophenol
InChI Key CUTFAPGINUFNQM-UHFFFAOYSA-N
Molecular Formula C6H4BrNO3
5,363

D-gamma-Tocopherol, 95%

CAS: 54-28-4 Molecular Formula: C28H48O2 Molecular Weight (g/mol): 416.69 MDL Number: MFCD00066529 InChI Key: QUEDXNHFTDJVIY-DQCZWYHMSA-N Synonym: gamma-tocopherol,+-gamma-tocopherol,d-gamma-tocopherol,7,8-dimethyltocol,unii-8ef1z1238f,rrr-gamma-tocopherol,r,r,r-gamma-tocopherol,2r-2,7,8-trimethyl-2-4r,8r-4,8,12-trimethyltridecyl chroman-6-ol,2r-2,7,8-trimethyl-2-4r,8r-4,8,12-trimethyltridecyl-3,4-dihydro-2h-chromen-6-ol,2r-3,4-dihydro-2,7,8-trimethyl-2-4r,8r-4,8,12-trimethyltridecyl-2h-1-benzopyran-6-ol PubChem CID: 92729 ChEBI: CHEBI:18185 IUPAC Name: (2R)-2,7,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-ol SMILES: CC1=C(C=C2CCC(OC2=C1C)(C)CCCC(C)CCCC(C)CCCC(C)C)O

PubChem CID 92729
CAS 54-28-4
Molecular Weight (g/mol) 416.69
ChEBI CHEBI:18185
MDL Number MFCD00066529
SMILES CC1=C(C=C2CCC(OC2=C1C)(C)CCCC(C)CCCC(C)CCCC(C)C)O
Synonym gamma-tocopherol,+-gamma-tocopherol,d-gamma-tocopherol,7,8-dimethyltocol,unii-8ef1z1238f,rrr-gamma-tocopherol,r,r,r-gamma-tocopherol,2r-2,7,8-trimethyl-2-4r,8r-4,8,12-trimethyltridecyl chroman-6-ol,2r-2,7,8-trimethyl-2-4r,8r-4,8,12-trimethyltridecyl-3,4-dihydro-2h-chromen-6-ol,2r-3,4-dihydro-2,7,8-trimethyl-2-4r,8r-4,8,12-trimethyltridecyl-2h-1-benzopyran-6-ol
IUPAC Name (2R)-2,7,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-ol
InChI Key QUEDXNHFTDJVIY-DQCZWYHMSA-N
Molecular Formula C28H48O2
5,364

Benzoic acid, 99.6%, ACS reagent

CAS: 65-85-0 Molecular Formula: C7H6O2 Molecular Weight (g/mol): 122.12 InChI Key: WPYMKLBDIGXBTP-UHFFFAOYSA-N Synonym: benzenecarboxylic acid,dracylic acid,benzeneformic acid,carboxybenzene,phenylformic acid,benzenemethanoic acid,phenylcarboxylic acid,retardex,benzoesaeure gk,benzoesaeure gv PubChem CID: 243 ChEBI: CHEBI:30746 IUPAC Name: benzoic acid SMILES: C1=CC=C(C=C1)C(=O)O

PubChem CID 243
CAS 65-85-0
Molecular Weight (g/mol) 122.12
ChEBI CHEBI:30746
SMILES C1=CC=C(C=C1)C(=O)O
Synonym benzenecarboxylic acid,dracylic acid,benzeneformic acid,carboxybenzene,phenylformic acid,benzenemethanoic acid,phenylcarboxylic acid,retardex,benzoesaeure gk,benzoesaeure gv
IUPAC Name benzoic acid
InChI Key WPYMKLBDIGXBTP-UHFFFAOYSA-N
Molecular Formula C7H6O2
5,365

(4-Bromophenoxy)-tert-butyldimethylsilane, 97%

CAS: 67963-68-2 Molecular Formula: C12H19BrOSi Molecular Weight (g/mol): 287.27 MDL Number: MFCD00239382 InChI Key: DLGZGLKSNRKLSM-UHFFFAOYSA-N Synonym: 4-bromophenoxy tert-butyl dimethylsilane,4-bromophenoxy-tert-butyldimethylsilane,p-bromophenoxy t-butyl dimethylsilane,4-bromophenoxy-tert-butyl-dimethylsilane,1-bromo-4-tert-butyldimethylsiloxy benzene,4-bromophenol tert-butyldimethylsilyl ether,silane, 4-bromophenoxy 1,1-dimethylethyl dimethyl,1-bromo-4-1,1-dimethylethyl dimethylsilyl oxy benzene,acmc-1b8oo PubChem CID: 4227167 IUPAC Name: (4-bromophenoxy)-tert-butyl-dimethylsilane SMILES: CC(C)(C)[Si](C)(C)OC1=CC=C(C=C1)Br

PubChem CID 4227167
CAS 67963-68-2
Molecular Weight (g/mol) 287.27
MDL Number MFCD00239382
SMILES CC(C)(C)[Si](C)(C)OC1=CC=C(C=C1)Br
Synonym 4-bromophenoxy tert-butyl dimethylsilane,4-bromophenoxy-tert-butyldimethylsilane,p-bromophenoxy t-butyl dimethylsilane,4-bromophenoxy-tert-butyl-dimethylsilane,1-bromo-4-tert-butyldimethylsiloxy benzene,4-bromophenol tert-butyldimethylsilyl ether,silane, 4-bromophenoxy 1,1-dimethylethyl dimethyl,1-bromo-4-1,1-dimethylethyl dimethylsilyl oxy benzene,acmc-1b8oo
IUPAC Name (4-bromophenoxy)-tert-butyl-dimethylsilane
InChI Key DLGZGLKSNRKLSM-UHFFFAOYSA-N
Molecular Formula C12H19BrOSi
5,366

4-(Trifluoromethyl)phenylacetylene, 97%

CAS: 705-31-7 Molecular Formula: C9H5F3 Molecular Weight (g/mol): 170.13 MDL Number: MFCD01861903 InChI Key: XTKBMZQCDBHHKY-UHFFFAOYSA-N Synonym: 1-ethynyl-4-trifluoromethyl benzene,4'-trifluoromethylphenyl acetylene,4-trifluoromethyl phenylacetylene,4-ethynyl-alpha,alpha,alpha-trifluorotoluene,4-ethynylbenzotrifluoride,4-ethynyl-a,a,a-trifluorotoluene,4-ethynyl trifluorotoluene,benzene, 1-ethynyl-4-trifluoromethyl,1-ethynyl-4-trifluoromethyl-benzene,4-ethynyl-1-trifluoromethyl benzene PubChem CID: 4348295 IUPAC Name: 1-ethynyl-4-(trifluoromethyl)benzene SMILES: FC(F)(F)C1=CC=C(C=C1)C#C

PubChem CID 4348295
CAS 705-31-7
Molecular Weight (g/mol) 170.13
MDL Number MFCD01861903
SMILES FC(F)(F)C1=CC=C(C=C1)C#C
Synonym 1-ethynyl-4-trifluoromethyl benzene,4'-trifluoromethylphenyl acetylene,4-trifluoromethyl phenylacetylene,4-ethynyl-alpha,alpha,alpha-trifluorotoluene,4-ethynylbenzotrifluoride,4-ethynyl-a,a,a-trifluorotoluene,4-ethynyl trifluorotoluene,benzene, 1-ethynyl-4-trifluoromethyl,1-ethynyl-4-trifluoromethyl-benzene,4-ethynyl-1-trifluoromethyl benzene
IUPAC Name 1-ethynyl-4-(trifluoromethyl)benzene
InChI Key XTKBMZQCDBHHKY-UHFFFAOYSA-N
Molecular Formula C9H5F3
5,367

Benzyl alcohol, ACS reagent

CAS: 100-51-6 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00004599,MFCD03792087 InChI Key: WVDDGKGOMKODPV-UHFFFAOYSA-N Synonym: benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol PubChem CID: 244 ChEBI: CHEBI:17987 IUPAC Name: phenylmethanol SMILES: OCC1=CC=CC=C1

PubChem CID 244
CAS 100-51-6
Molecular Weight (g/mol) 108.14
ChEBI CHEBI:17987
MDL Number MFCD00004599,MFCD03792087
SMILES OCC1=CC=CC=C1
Synonym benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol
IUPAC Name phenylmethanol
InChI Key WVDDGKGOMKODPV-UHFFFAOYSA-N
Molecular Formula C7H8O
5,368

Methyl 4-(trifluoromethyl)benzoate, 98%

CAS: 2967-66-0 Molecular Formula: C9H7F3O2 Molecular Weight (g/mol): 204.15 MDL Number: MFCD00042324 InChI Key: VAZWXPJOOFSNLB-UHFFFAOYSA-N Synonym: methyl 4-trifluoromethyl benzoate,methyl-4-trifluoromethyl benzoate,4-trifluoromethyl benzoic acid methyl ester,methyl-4-trifluoromethylbenzoate,3-cf3-c6h4-cooch3,methyl p-trifluoromethyl benzoate,methyl alpha,alpha,alpha-trifluoro-p-toluate,benzoic acid, 4-trifluoromethyl-, methyl ester,pubchem14120,acmc-209hab PubChem CID: 520447 IUPAC Name: methyl 4-(trifluoromethyl)benzoate SMILES: COC(=O)C1=CC=C(C=C1)C(F)(F)F

PubChem CID 520447
CAS 2967-66-0
Molecular Weight (g/mol) 204.15
MDL Number MFCD00042324
SMILES COC(=O)C1=CC=C(C=C1)C(F)(F)F
Synonym methyl 4-trifluoromethyl benzoate,methyl-4-trifluoromethyl benzoate,4-trifluoromethyl benzoic acid methyl ester,methyl-4-trifluoromethylbenzoate,3-cf3-c6h4-cooch3,methyl p-trifluoromethyl benzoate,methyl alpha,alpha,alpha-trifluoro-p-toluate,benzoic acid, 4-trifluoromethyl-, methyl ester,pubchem14120,acmc-209hab
IUPAC Name methyl 4-(trifluoromethyl)benzoate
InChI Key VAZWXPJOOFSNLB-UHFFFAOYSA-N
Molecular Formula C9H7F3O2
5,369

4-Chlorophenol, 99%

CAS: 106-48-9 Molecular Formula: C6H5ClO Molecular Weight (g/mol): 128.555 MDL Number: MFCD00002318 InChI Key: WXNZTHHGJRFXKQ-UHFFFAOYSA-N Synonym: p-chlorophenol,parachlorophenol,phenol, 4-chloro,4-hydroxychlorobenzene,phenol, p-chloro,applied 3-78,4-monochlorophenol,p-chlorophenic acid,p-chlorfenol,4-chloro-1-hydroxybenzene PubChem CID: 4684 ChEBI: CHEBI:28078 IUPAC Name: 4-chlorophenol SMILES: C1=CC(=CC=C1O)Cl

PubChem CID 4684
CAS 106-48-9
Molecular Weight (g/mol) 128.555
ChEBI CHEBI:28078
MDL Number MFCD00002318
SMILES C1=CC(=CC=C1O)Cl
Synonym p-chlorophenol,parachlorophenol,phenol, 4-chloro,4-hydroxychlorobenzene,phenol, p-chloro,applied 3-78,4-monochlorophenol,p-chlorophenic acid,p-chlorfenol,4-chloro-1-hydroxybenzene
IUPAC Name 4-chlorophenol
InChI Key WXNZTHHGJRFXKQ-UHFFFAOYSA-N
Molecular Formula C6H5ClO
5,370

p-Toluenesulfonyl isocyanate, 95%

CAS: 4083-64-1 Molecular Formula: C8H7NO3S Molecular Weight (g/mol): 197.21 MDL Number: MFCD00002030 InChI Key: VLJQDHDVZJXNQL-UHFFFAOYSA-N Synonym: tosyl isocyanate,p-toluenesulfonyl isocyanate,4-methylbenzenesulfonyl isocyanate,p-toluenesulphonyl isocyanate,benzenesulfonyl isocyanate, 4-methyl,tosylisocyanate,p-tolylsulfonyl isocyanate,unii-h9004fjx6v,p-toluenesulfonic acid, anhydride with isocyanic acid,p-toluene sulfonyl isocyanate PubChem CID: 77703 IUPAC Name: 4-methyl-N-(oxomethylidene)benzenesulfonamide SMILES: CC1=CC=C(C=C1)S(=O)(=O)N=C=O

PubChem CID 77703
CAS 4083-64-1
Molecular Weight (g/mol) 197.21
MDL Number MFCD00002030
SMILES CC1=CC=C(C=C1)S(=O)(=O)N=C=O
Synonym tosyl isocyanate,p-toluenesulfonyl isocyanate,4-methylbenzenesulfonyl isocyanate,p-toluenesulphonyl isocyanate,benzenesulfonyl isocyanate, 4-methyl,tosylisocyanate,p-tolylsulfonyl isocyanate,unii-h9004fjx6v,p-toluenesulfonic acid, anhydride with isocyanic acid,p-toluene sulfonyl isocyanate
IUPAC Name 4-methyl-N-(oxomethylidene)benzenesulfonamide
InChI Key VLJQDHDVZJXNQL-UHFFFAOYSA-N
Molecular Formula C8H7NO3S