methyl (2R,3S)-4-azanyl-3-(3,4-dimethoxyphenyl)-2-(1H-indol-3-yl)butanoate

Systemtic Name: methyl (2R,3S)-4-azanyl-3-(3,4-dimethoxyphenyl)-2-(1H-indol-3-yl)butanoate Openeye Name: methyl (2R,3S)-4-amino-3-(3,4-dimethoxyphenyl)-2-(1H-indol-3-yl)butanoate CAS Name: (2R,3S)-4-amino-3-(3,4-dimethoxyphenyl)-2-(1H-indol-3-yl)butanoic acid methyl ester IUPAC Name: methyl (2R,3S)-4-amino-3-(3,4-dimethoxyphenyl)-2-(1H-indol-3-yl)butanoate Traditional Name: (2R,3S)-4-amino-3-(3,4-dimethoxyphenyl)-2-(1H-indol-3-yl)butyric acid methyl ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CN)C(C2=CNC3=CC=CC=C32)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H](CN)[C@H](C2=CNC3=CC=CC=C32)C(=O)OC)OC

InChI

InChI=1S/C21H24N2O4/c1-25-18-9-8-13(10-19(18)26-2)15(11-22)20(21(24)27-3)16-12-23-17-7-5-4-6-14(16)17/h4-10,12,15,20,23H,11,22H2,1-3H3/t15-,20-/m1/s1