methyl 4-[3-oxidanylidene-2-(phenylmethyl)-9H-pyrido[3,4-b]indol-1-yl]butanoate

Systemtic Name: methyl 4-[3-oxidanylidene-2-(phenylmethyl)-9H-pyrido[3,4-b]indol-1-yl]butanoate Openeye Name: methyl 4-(2-benzyl-3-oxo-9H-pyrido[3,4-b]indol-1-yl)butanoate CAS Name: 4-[3-oxo-2-(phenylmethyl)-9H-pyrido[3,4-b]indol-1-yl]butanoic acid methyl ester IUPAC Name: methyl 4-(2-benzyl-3-oxo-9H-pyrido[3,4-b]indol-1-yl)butanoate Traditional Name: 4-(2-benzyl-3-keto-9H-$b-carbolin-1-yl)butyric acid methyl ester Formula: C23H22N2O3 MolecularWeight: 374.43238

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=C2C(=CC(=O)N1CC3=CC=CC=C3)C4=CC=CC=C4N2

Isomeric SMILES

COC(=O)CCCC1=C2C(=CC(=O)N1CC3=CC=CC=C3)C4=CC=CC=C4N2

InChI

InChI=1S/C23H22N2O3/c1-28-22(27)13-7-12-20-23-18(17-10-5-6-11-19(17)24-23)14-21(26)25(20)15-16-8-3-2-4-9-16/h2-6,8-11,14,24H,7,12-13,15H2,1H3