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

Systemtic Name: 6-[(4-fluoranyl-1-oxidanyl-cyclohexa-2,4-dien-1-yl)methyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 6-[(4-fluoro-1-hydroxy-cyclohexa-2,4-dien-1-yl)methyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 6-[(4-fluoro-1-hydroxy-1-cyclohexa-2,4-dienyl)methyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 6-[(4-fluoro-1-hydroxycyclohexa-2,4-dien-1-yl)methyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 6-[(4-fluoro-1-hydroxy-cyclohexa-2,4-dien-1-yl)methyl]-9H-$b-carboline-3-carboxylic acid Formula: C19H15FN2O3 MolecularWeight: 338.332403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15FN2O3/c20-12-3-5-19(25,6-4-12)9-11-1-2-15-13(7-11)14-8-16(18(23)24)21-10-17(14)22-15/h1-5,7-8,10,22,25H,6,9H2,(H,23,24)