6-[(1-oxidanylcyclohexa-2,4-dien-1-yl)methyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 6-[(1-oxidanylcyclohexa-2,4-dien-1-yl)methyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 6-[(1-hydroxycyclohexa-2,4-dien-1-yl)methyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 6-[(1-hydroxy-1-cyclohexa-2,4-dienyl)methyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 6-[(1-hydroxycyclohexa-2,4-dien-1-yl)methyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 6-[(1-hydroxycyclohexa-2,4-dien-1-yl)methyl]-9H-$b-carboline-3-carboxylic acid Formula: C19H16N2O3 MolecularWeight: 320.34194

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=CC1(CC2=CC3=C(C=C2)NC4=CN=C(C=C34)C(=O)O)O

Isomeric SMILES

C1C=CC=CC1(CC2=CC3=C(C=C2)NC4=CN=C(C=C34)C(=O)O)O

InChI

InChI=1S/C19H16N2O3/c22-18(23)16-9-14-13-8-12(10-19(24)6-2-1-3-7-19)4-5-15(13)21-17(14)11-20-16/h1-6,8-9,11,21,24H,7,10H2,(H,22,23)