methyl (2S)-2-[[(1S)-1-cyanoethyl]amino]-3-(1H-indol-3-yl)propanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)NC(CC1=CNC2=CC=CC=C21)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C15H17N3O2/c1-10(8-16)18-14(15(19)20-2)7-11-9-17-13-6-4-3-5-12(11)13/h3-6,9-10,14,17-18H,7H2,1-2H3/t10-,14-/m0/s1