methyl 2-(aminomethyl)-4-(1H-indol-3-yl)-3-phenyl-butanoate

Systemtic Name: methyl 2-(aminomethyl)-4-(1H-indol-3-yl)-3-phenyl-butanoate Openeye Name: methyl 2-(aminomethyl)-4-(1H-indol-3-yl)-3-phenyl-butanoate CAS Name: 2-(aminomethyl)-4-(1H-indol-3-yl)-3-phenylbutanoic acid methyl ester IUPAC Name: methyl 2-(aminomethyl)-4-(1H-indol-3-yl)-3-phenylbutanoate Traditional Name: 2-(aminomethyl)-4-(1H-indol-3-yl)-3-phenyl-butyric acid methyl ester Formula: C20H22N2O2 MolecularWeight: 322.40088

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CN)C(CC1=CNC2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C(CN)C(CC1=CNC2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C20H22N2O2/c1-24-20(23)18(12-21)17(14-7-3-2-4-8-14)11-15-13-22-19-10-6-5-9-16(15)19/h2-10,13,17-18,22H,11-12,21H2,1H3