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

Systemtic Name: methyl (2R,3S)-4-azanyl-2-(1H-indol-3-yl)-3-(4-methoxyphenyl)butanoate Openeye Name: methyl (2R,3S)-4-amino-2-(1H-indol-3-yl)-3-(4-methoxyphenyl)butanoate CAS Name: (2R,3S)-4-amino-2-(1H-indol-3-yl)-3-(4-methoxyphenyl)butanoic acid methyl ester IUPAC Name: methyl (2R,3S)-4-amino-2-(1H-indol-3-yl)-3-(4-methoxyphenyl)butanoate Traditional Name: (2R,3S)-4-amino-2-(1H-indol-3-yl)-3-(4-methoxyphenyl)butyric acid methyl ester Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O3/c1-24-14-9-7-13(8-10-14)16(11-21)19(20(23)25-2)17-12-22-18-6-4-3-5-15(17)18/h3-10,12,16,19,22H,11,21H2,1-2H3/t16-,19-/m1/s1