methyl (2S)-2-(2-cyanoethylamino)-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl (2S)-2-(2-cyanoethylamino)-3-(1H-indol-3-yl)propanoate Openeye Name: methyl (2S)-2-(2-cyanoethylamino)-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-(2-cyanoethylamino)-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-(2-cyanoethylamino)-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-2-(2-cyanoethylamino)-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C15H17N3O2 MolecularWeight: 271.31438

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NCCC#N

Isomeric SMILES

COC(=O)[C@H](CC1=CNC2=CC=CC=C21)NCCC#N

InChI

InChI=1S/C15H17N3O2/c1-20-15(19)14(17-8-4-7-16)9-11-10-18-13-6-3-2-5-12(11)13/h2-3,5-6,10,14,17-18H,4,8-9H2,1H3/t14-/m0/s1