Organoheterocyclic compounds

7-Bromo-4-methyl-3,4-dihydro-2H-1,4-benzoxazine, 95%, Maybridge

CAS: 154264-95-6 Molecular Formula: C9H10BrNO Molecular Weight (g/mol): 228.089 MDL Number: MFCD02681913 InChI Key: MQMFOFZKZBLSAB-UHFFFAOYSA-N Synonym: 7-bromo-4-methyl-3,4-dihydro-2h-1,4-benzoxazine, 7-bromo-3,4-dihydro-4-methyl-2h-1,4-benzoxazine, 2h-1,4-benzoxazine, 7-bromo-3,4-dihydro-4-methyl, 7-bromo-4-methyl-3,4-dihydro-2h-benzo b 1,4 oxazine, 7-bromo-4-methyl-2h,3h-benzo e 1,4-oxazine, 2h-1,4-benzoxazine,7-bromo-3,4-dihydro-4-methyl, 7-bromo-4-methyl-3,4-dihydro-2h-benzo 1,4 oxazine PubChem CID: 2776405 IUPAC Name: 7-bromo-4-methyl-2,3-dihydro-1,4-benzoxazine SMILES: CN1CCOC2=C1C=CC(=C2)Br

Alfa Aesar™ (S)-2-Aminomethyl-1-Boc-pyrrolidine, 97%

CAS: 119020-01-8 Molecular Formula: C10H20N2O2 Molecular Weight (g/mol): 200.282 MDL Number: MFCD03419257 InChI Key: SOGXYCNKQQJEED-QMMMGPOBSA-N Synonym: s-1-boc-2-aminomethyl pyrrolidine, s-1-n-boc-2-aminomethyl pyrrolidine, s-tert-butyl 2-aminomethyl pyrrolidine-1-carboxylate, tert-butyl 2s-2-aminomethyl pyrrolidine-1-carboxylate, s-2-aminomethyl-1-n-boc-pyrrolidine, s-2-aminomethyl-1-boc-pyrrolidine, s-2-aminomethyl-1-boc-pyrrolidine, tert-butyl s-2-aminomethylpyrrolidine-1-carboxylate, s-2-aminomethyl-1-n-boc-pyrrolidine, s-2-aminomethyl-1-n-boc-pyyrolidine PubChem CID: 1512533 IUPAC Name: tert-butyl (2S)-2-(aminomethyl)pyrrolidine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCCC1CN

Cycloheximide, 95%, ACROS Organics™

CAS: 66-81-9 Molecular Formula: C15H23NO4 Molecular Weight (g/mol): 281.352 MDL Number: MFCD00082346 InChI Key: YPHMISFOHDHNIV-FSZOTQKASA-N Synonym: cycloheximide, actidione, cicloheximide, naramycin a, kaken, actidion, actidone, hizarocin, naramycin, neocycloheximide PubChem CID: 6197 ChEBI: CHEBI:27641 IUPAC Name: 4-[(2R)-2-[(1S,3S,5S)-3,5-dimethyl-2-oxocyclohexyl]-2-hydroxyethyl]piperidine-2,6-dione SMILES: CC1CC(C(=O)C(C1)C(CC2CC(=O)NC(=O)C2)O)C

Alfa Aesar™ (S)-(+)-1-Boc-3-(methylamino)piperidine, 96%

CAS: 912368-73-1 Molecular Formula: C11H22N2O2 Molecular Weight (g/mol): 214.309 MDL Number: MFCD09752964 InChI Key: XRRRUOWSHGFPTI-VIFPVBQESA-N Synonym: s-1-n-boc-3-methylaminopiperidine, s-tert-butyl 3-methylamino piperidine-1-carboxylate, s-3-methylamino-piperidine-1-carboxylic acid tert-butyl ester, 1-n-boc-3-s-methylamino-piperidine, tert-butyl 3s-3-methylamino piperidine-1-carboxylate, pubchem14246, s-n-boc-3-methylamino piperidine, s-1-boc-3-methylamino piperidine, s-1-boc-3-methylamino piperidine, s-1-boc-3-methylamino piperidine PubChem CID: 25631268 IUPAC Name: tert-butyl (3S)-3-(methylamino)piperidine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCCC(C1)NC

Barbituric Acid, Fisher Chemical Available on GSA/VA Contract for Federal Government customers only.

CAS: 67-52-7 Molecular Formula: C4H4N2O3 Molecular Weight (g/mol): 128.087 MDL Number: MFCD00006666 InChI Key: HNYOPLTXPVRDBG-UHFFFAOYSA-N Synonym: barbituric acid, malonylurea, 2,4,6 1h,3h,5h-pyrimidinetrione, 6-hydroxyuracil, pyrimidinetrione, 2,4,6-trihydroxypyrimidine, 2,4,6-pyrimidinetrione, pyrimidine-2,4,6 1h,3h,5h-trione, barbiturate, malonylharnstoff PubChem CID: 6211 ChEBI: CHEBI:16294 IUPAC Name: 1,3-diazinane-2,4,6-trione SMILES: C1C(=O)NC(=O)NC1=O

Alfa Aesar™ 5-Bromo-5-nitro-1,3-dioxane, 98%

CAS: 30007-47-7 Molecular Formula: C4H6BrNO4 Molecular Weight (g/mol): 211.999 MDL Number: MFCD00101855 InChI Key: XVBRCOKDZVQYAY-UHFFFAOYSA-N Synonym: bronidox, 1,3-dioxane, 5-bromo-5-nitro, 5-bromo-5-nitro-m-dioxane, unii-u184i9qbnm, 5-brom-5-nitro-1,3-dioxan, m-dioxane, 5-bromo-5-nitro, 5-brom-5-nitro-1,3-dioxan german, u184i9qbnm, bronidox l, acmc-209hcf PubChem CID: 1807 IUPAC Name: 5-bromo-5-nitro-1,3-dioxane SMILES: C1C(COCO1)([N+](=O)[O-])Br

Maleic Anhydride (Pellets/Reagent/99%), ACROS Organics™

CAS: 108-31-6 Molecular Formula: C4H2O3 Molecular Weight (g/mol): 98.057 InChI Key: FPYJFEHAWHCUMM-UHFFFAOYSA-N Synonym: maleic anhydride, 2,5-furandione, maleic acid anhydride, toxilic anhydride, dihydro-2,5-dioxofuran, cis-butenedioic anhydride, 2,5-dihydrofuran-2,5-dione, polymaleic anhydride, maleinanhydrid, rcra waste number u147 PubChem CID: 7923 ChEBI: CHEBI:474859 IUPAC Name: furan-2,5-dione SMILES: C1=CC(=O)OC1=O

Phenothiazine, 99%, ACROS Organics™

CAS: 92-84-2 Molecular Formula: C12H9NS Molecular Weight (g/mol): 199.271 MDL Number: MFCD00005015 InChI Key: WJFKNYWRSNBZNX-UHFFFAOYSA-N Synonym: phenothiazine, thiodiphenylamine, feeno, dibenzothiazine, phenosan, phenthiazine, dibenzo-1,4-thiazine, penthazine, souframine, agrazine PubChem CID: 7108 ChEBI: CHEBI:37931 IUPAC Name: 10H-phenothiazine SMILES: C1=CC=C2C(=C1)NC3=CC=CC=C3S2

Indomethacin, Acros Organics™

CAS: 53-86-1 Molecular Formula: C19H16ClNO4 Molecular Weight (g/mol): 357.79 InChI Key: CGIGDMFJXJATDK-UHFFFAOYSA-N Synonym: indomethacin, indometacin, indocin, indometacine, indomethacine, indocid, metindol, amuno, indomethazine, imbrilon PubChem CID: 3715 ChEBI: CHEBI:49662 IUPAC Name: 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid SMILES: CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)O

1,4-Dioxane (Certified ACS), Fisher Chemical Available on GSA/VA Contract for Federal Government customers only.

CAS: 123-91-1 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.106 MDL Number: MFCD00006571 InChI Key: RYHBNJHYFVUHQT-UHFFFAOYSA-N Synonym: dioxane, p-dioxane, 1,4-diethylene dioxide, diethylene ether, dioxan, 1,4-dioxacyclohexane, diethylene dioxide, dioxanne, di ethylene oxide, tetrahydro-p-dioxin PubChem CID: 31275 ChEBI: CHEBI:47032 IUPAC Name: 1,4-dioxane SMILES: C1COCCO1

Alfa Aesar™ 2-Amino-4-(4-pyridyl)thiazole, 97%

CAS: 30235-28-0 Molecular Formula: C8H7N3S Molecular Weight (g/mol): 177.225 MDL Number: MFCD00490009 InChI Key: CUSJGENRTWNHPV-UHFFFAOYSA-N Synonym: 4-pyridin-4-yl-thiazol-2-ylamine, 4-pyridin-4-yl thiazol-2-amine, 2-amino-4-4-pyridyl thiazole, 4-pyridin-4-yl-1,3-thiazol-2-amine, 4-4-pyridinyl-2-thiazolamine, 4-4-pyridinyl-1,3-thiazol-2-amine, 4-4-pyridinyl-1,3-thiazol-2-ylamine, 2-thiazolamine, 4-4-pyridinyl, 4-4-pyridyl-1,3-thiazol-2-amine, 2-amino-4-pyridin-4-yl-1,3-thiazole PubChem CID: 930237 IUPAC Name: 4-pyridin-4-yl-1,3-thiazol-2-amine SMILES: C1=CN=CC=C1C2=CSC(=N2)N

Selenophene, 99%, ACROS Organics™

CAS: 288-05-1 Molecular Formula: C4H4Se Molecular Weight (g/mol): 131.047 MDL Number: MFCD00075487 InChI Key: MABNMNVCOAICNO-UHFFFAOYSA-N Synonym: selenophen, selenophene, acmc-1cr2h PubChem CID: 136130 ChEBI: CHEBI:30857 IUPAC Name: selenophene SMILES: C1=C[Se]C=C1

Alfa Aesar™ Thiodiglycolic anhydride, 98%

CAS: 3261-87-8 Molecular Formula: C4H4O3S Molecular Weight (g/mol): 132.133 MDL Number: MFCD00051689 InChI Key: RIIUAPMWDSRBSH-UHFFFAOYSA-N Synonym: thiodiglycolic anhydride, 1-oxa-4-thia-cyclohexan-2,6-dione PubChem CID: 137871 IUPAC Name: 1,4-oxathiane-2,6-dione SMILES: C1C(=O)OC(=O)CS1

Alfa Aesar™ Bicinchoninic acid disodium salt

CAS: 979-88-4 Molecular Formula: C20H10N2Na2O4 Molecular Weight (g/mol): 388.29 MDL Number: MFCD00037500 InChI Key: AUPXFICLXPLHBB-UHFFFAOYSA-L Synonym: sodium 2,2'-biquinoline-4,4'-dicarboxylate, 2,2'-biquinoline-4,4-dicarboxylic acid disodium salt, 2,2'-biquinoline-4,4'-dicarboxylic acid, disodium salt, sodium bicinchoninate, 2,2'-biquinoline-4,4'-dicarboxylic acid disodium salt, disodium 2,2'-biquinoline-4,4'-dicarboxylate, bicinchoninic acid disodium salt, bca, 2,2'-biquinoline-4,4'-dicarboxylic acid, disodium salt, 2,2'-biquinoline-4,4'-dicarboxylic acid, sodium salt 1:2 PubChem CID: 164763 IUPAC Name: disodium;2-(4-carboxylatoquinolin-2-yl)quinoline-4-carboxylate SMILES: C1=CC=C2C(=C1)C(=CC(=N2)C3=NC4=CC=CC=C4C(=C3)C(=O)[O-])C(=O)[O-].[Na+].[Na+]

2-Fluoroadenine, 97%, Acros Organics™

CAS: 700-49-2 Molecular Formula: C5H4FN5 Molecular Weight (g/mol): 153.12 InChI Key: WKMPTBDYDNUJLF-UHFFFAOYSA-N Synonym: 2-fluoroadenine, 2-fluoro-6-aminopurine, 2-fluoro-1h-purin-6-amine, 2-fad, 2-fluoro-9h-purin-6-amine, 6-amino-2-fluoropurine, 2-fluoro-7 9 h-purin-6-ylamine, purine, 6-amino-2-fluoro, fluoroadenine, 1h-purin-6-amine, 2-fluoro PubChem CID: 12790 ChEBI: CHEBI:72457 IUPAC Name: 2-fluoro-7H-purin-6-amine SMILES: C1=NC2=C(N1)C(=NC(=N2)F)N

Pyridine (Certified ACS), Fisher Chemical

CAS: 110-86-1 Molecular Formula: C5H5N Molecular Weight (g/mol): 79.102 MDL Number: MFCD00011732 InChI Key: JUJWROOIHBZHMG-UHFFFAOYSA-N Synonym: azabenzene, azine, pyridin, piridina, pirydyna, pyridin german, pirydyna polish, piridina italian, rcra waste number u196, caswell no. 717 PubChem CID: 1049 ChEBI: CHEBI:16227 IUPAC Name: pyridine SMILES: C1=CC=NC=C1

Alfa Aesar™ 1-Boc-indole-2-boronic acid, 95%

CAS: 213318-44-6 Molecular Formula: C13H16BNO4 Molecular Weight (g/mol): 261.084 MDL Number: MFCD02093045 InChI Key: SVIBPSNFXYUOFT-UHFFFAOYSA-N Synonym: n-boc-indole-2-boronic acid, 1-boc-indole-2-boronic acid, 1-tert-butoxycarbonyl indole-2-boronic acid, 1-tert-butoxycarbonyl-1h-indol-2-ylboronic acid, 1-tert-butoxycarbonyl-1h-indol-2-yl boronic acid, 1-n-boc-indole-2-boronic acid, 1-tert-butoxycarbonyl-1h-indol-2-yl-2-boronic acid, 1-tert-butoxycarbonyl indol-2-ylboronic acid, 1-boc-2-indoleboronic acid, n-boc-indol-2-yl boronic acid PubChem CID: 2773302 IUPAC Name: [1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic acid SMILES: B(C1=CC2=CC=CC=C2N1C(=O)OC(C)(C)C)(O)O

8-Hydroxyquinoline (Certified ACS), Fisher Chemical

CAS: 148-24-3 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.161 MDL Number: MFCD00006807 InChI Key: MCJGNVYPOGVAJF-UHFFFAOYSA-N Synonym: 8-hydroxyquinoline, 8-quinolinol, oxyquinoline, oxine, quinophenol, 8-quinol, 8-oxyquinoline, phenopyridine, oxychinolin, bioquin PubChem CID: 1923 ChEBI: CHEBI:48981 IUPAC Name: quinolin-8-ol SMILES: C1=CC2=C(C(=C1)O)N=CC=C2

Alfa Aesar™ 9-BBN dimer, 98%

CAS: 21205-91-4 Molecular Formula: C16H28B2 Molecular Weight (g/mol): 242.02 MDL Number: MFCD00168069 InChI Key: IYDIZBOKVLHCQZ-UHFFFAOYSA-N Synonym: 9-bbn dimer, 9-borabicyclo 3.3.1 nonane dimer, 9,9'-bi-9-borabicyclo 3.3.1 nonane, 9-9-borabicyclo 3.3.1 nonan-9-yl-9-borabicyclo 3.3.1 nonane, 9-bbn-dimer, acmc-20n4wy, 9,9/'-bi-9-borabicyclo 3.3.1 nonane, 1,1-1,5-cyclooctanediyl-2,2-1,5-cyclooctanediyl diborane 4, 1s,5s-9-1s,5s-9-borabicyclo 3.3.1 nonan-9-yl-9-borabicyclo 3.3.1 nonane PubChem CID: 11322441 IUPAC Name: 9-(9-borabicyclo[3.3.1]nonan-9-yl)-9-borabicyclo[3.3.1]nonane SMILES: B1(C2CCCC1CCC2)B3C4CCCC3CCC4

D-(+)-Biotin, ≥98%, Alfa Aesar™

CAS: 58-85-5 Molecular Formula: C10H16N2O3S Molecular Weight (g/mol): 244.309 MDL Number: MFCD00005541 InChI Key: YBJHBAHKTGYVGT-ZKWXMUAHSA-N Synonym: biotin, d-biotin, vitamin h, coenzyme r, vitamin b7, bios ii, factor s, bioepiderm, d +-biotin, biodermatin PubChem CID: 171548 ChEBI: CHEBI:15956 IUPAC Name: 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid SMILES: C1C2C(C(S1)CCCCC(=O)O)NC(=O)N2

Alfa Aesar™ 2,5-Dimethylpyrrole-3-carboxylic acid, 97%

CAS: 57338-76-8 Molecular Formula: C7H9NO2 Molecular Weight (g/mol): 139.154 MDL Number: MFCD00203874 InChI Key: VDVWTJFVFQVCFN-UHFFFAOYSA-N Synonym: 2,5-dimethylpyrrole-3-carboxylic acid, 1h-pyrrole-3-carboxylic acid, 2,5-dimethyl, 2,5-dimethyl-4-carboxypyrrole, 1h-pyrrole-3-carboxylicacid, 2,5-dimethyl PubChem CID: 292957 IUPAC Name: 2,5-dimethyl-1H-pyrrole-3-carboxylic acid SMILES: CC1=CC(=C(N1)C)C(=O)O

1-Methyl-2-pyrrolidinone (Laboratory), Fisher Chemical Available on GSA/VA Contract for Federal Government customers only.

CAS: 872-50-4 Molecular Formula: C5H9NO Molecular Weight (g/mol): 99.133 MDL Number: MFCD00003193 InChI Key: SECXISVLQFMRJM-UHFFFAOYSA-N Synonym: 1-methyl-2-pyrrolidinone, n-methyl-2-pyrrolidone, n-methylpyrrolidone, 1-methyl-2-pyrrolidone, methylpyrrolidone, m-pyrol, n-methyl-2-pyrrolidinone, n-methylpyrrolidinone, 1-methylpyrrolidinone, 2-pyrrolidinone, 1-methyl PubChem CID: 13387 ChEBI: CHEBI:7307 IUPAC Name: 1-methylpyrrolidin-2-one SMILES: CN1CCCC1=O

Linezolid, 98%, Acros Organics™

CAS: 165800-03-3 Molecular Formula: C16H20FN3O4 Molecular Weight (g/mol): 337.351 InChI Key: TYZROVQLWOKYKF-ZDUSSCGKSA-N Synonym: linezolid, zyvox, zyvoxid, s-n-3-3-fluoro-4-morpholinophenyl-2-oxooxazolidin-5-yl methyl acetamide, zyvoxam, linezolide, linezlid, zyvoxa, linezolid usan:inn, unii-isq9i6j12j PubChem CID: 441401 ChEBI: CHEBI:63607 IUPAC Name: N-[[(5S)-3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide SMILES: CC(=O)NCC1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCOCC3)F

Alfa Aesar™ Naloxone hydrochloride, 98%

CAS: 357-08-4 Molecular Formula: C19H22ClNO4 Molecular Weight (g/mol): 363.838 MDL Number: MFCD00069322 InChI Key: RGPDIGOSVORSAK-STHHAXOLSA-N Synonym: naloxone hydrochloride, naloxone hcl, narcan, naloxone hydrochloride, evzio, unii-f850569pqr, nalonee, 17-allyl-4,5alpha-epoxy-3,14-dihydroxymorphinan-6-one hydrochloride, narcan tn, naloxonehydrochloride PubChem CID: 5464092 IUPAC Name: (4R,4aS,7aR,12bS)-4a,9-dihydroxy-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride SMILES: C=CCN1CCC23C4C(=O)CCC2(C1CC5=C3C(=C(C=C5)O)O4)O.Cl

Metronidazole, 99%, ACROS Organics™

CAS: 443-48-1 Molecular Formula: C6H9N3O3 Molecular Weight (g/mol): 171.156 MDL Number: MFCD00009750 InChI Key: VAOCPAMSLUNLGC-UHFFFAOYSA-N Synonym: metronidazole, metronidazol, flagyl, 2-methyl-5-nitroimidazole-1-ethanol, anagiardil, trichazol, gineflavir, meronidal, metronidaz, novonidazol PubChem CID: 4173 ChEBI: CHEBI:6909 IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethanol SMILES: CC1=NC=C(N1CCO)[N+](=O)[O-]

Alfa Aesar™ Bis(ethylenedithiolo)tetrathiafulvalene

CAS: 66946-48-3 Molecular Formula: C10H8S8 Molecular Weight (g/mol): 384.654 MDL Number: MFCD00059710 InChI Key: LZJCVNLYDXCIBG-UHFFFAOYSA-N Synonym: bis ethylenedithio tetrathiafulvalene, bedt-ttf, 2-5h,6h-1,3 dithiolo 4,5-b 1,4 dithiin-2-ylidene-5h,6h-1,3 dithiolo 4,5-b 1,4 dithiine, bis ethylenedithio tetrathiofulvalene, bis ethylenedithiolo tetrathiafulvalene, bis ethylenedithio tetrathiafulvalene, bis-ethylenedithio tetrathiafulvalene, bis ethylenedithiolo tetrathiafulvalene 250mg, bi 5,6-dihydro-1,3-dithiolo 4,5-b 1,4-dithiine-2-ylidene, 2-5,6-dihydro-1,3 dithiolo 4,5-b 1,4 dithiin-2-ylidene-5,6-dihydro-1,3 dithiolo 4,5-b 1,4 dithiine PubChem CID: 633432 IUPAC Name: 2-(5,6-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiin-2-ylidene)-5,6-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiine SMILES: C1CSC2=C(S1)SC(=C3SC4=C(S3)SCCS4)S2

beta-Propiolactone, 97%, Alfa Aesar™

CAS: 57-57-8 Molecular Formula: C3H4O2 Molecular Weight (g/mol): 72.063 MDL Number: MFCD00005169 InChI Key: VEZXCJBBBCKRPI-UHFFFAOYSA-N Synonym: beta-propiolactone, propiolactone, 2-oxetanone, propanolide, betaprone, 3-propanolide, 1,3-propiolactone, 3-propiolactone, beta-propionolactone, beta-propiolakton PubChem CID: 2365 ChEBI: CHEBI:49073 IUPAC Name: oxetan-2-one SMILES: C1COC1=O

6-Mercaptopurine monohydrate, 99.5+%, ACROS Organics™

CAS: 6112-76-1 Molecular Formula: C5H6N4OS Molecular Weight (g/mol): 170.19 MDL Number: MFCD01461928 InChI Key: WFFQYWAAEWLHJC-UHFFFAOYSA-N Synonym: 6-mercaptopurine monohydrate, 6-mercaptopurine hydrate, mercaptopurine monohydrate, mercaptopurine hydrate, 6h-purine-6-thione, 1,7-dihydro-, monohydrate, 6,7-dihydro-3h-purine-6-thione hydrate, purine-6-thiol monohydrate, 1,7-dihydro-6h-purine-6-thione monohydrate, purine-6-thiol, monohydrate, unii-e7wed276i5 PubChem CID: 2724350 ChEBI: CHEBI:31822 IUPAC Name: 3,7-dihydropurine-6-thione;hydrate SMILES: C1=NC2=C(N1)C(=S)N=CN2.O

4-Nitroquinoline-N-oxide, 98%, ACROS Organics™

CAS: 56-57-5 Molecular Formula: C9H6N2O3 Molecular Weight (g/mol): 190.158 MDL Number: MFCD00006738 InChI Key: YHQDZJICGQWFHK-UHFFFAOYSA-N Synonym: 4-nitroquinoline n-oxide, 4-nitroquinoline 1-oxide, 4-nitroquinoline-1-oxide, nitrochin, 4-nitroquinoline-n-oxide, 4-nqo, quinoline, 4-nitro-, 1-oxide, 4-nitroquinoline oxide, 4 nqo, 4-nitroquinolin-1-oxide PubChem CID: 5955 ChEBI: CHEBI:16907 IUPAC Name: 4-nitro-1-oxidoquinolin-1-ium SMILES: C1=CC=C2C(=C1)C(=CC=[N+]2[O-])[N+](=O)[O-]

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