methyl (3S)-3-[4-(1H-indol-3-yl)butanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (3S)-3-[4-(1H-indol-3-yl)butanoylamino]-3-phenyl-propanoate Openeye Name: methyl (3S)-3-[4-(1H-indol-3-yl)butanoylamino]-3-phenyl-propanoate CAS Name: (3S)-3-[[4-(1H-indol-3-yl)-1-oxobutyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (3S)-3-[4-(1H-indol-3-yl)butanoylamino]-3-phenylpropanoate Traditional Name: (3S)-3-[4-(1H-indol-3-yl)butanoylamino]-3-phenyl-propionic acid methyl ester Formula: C22H24N2O3 MolecularWeight: 364.43756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)CCCC2=CNC3=CC=CC=C32

Isomeric SMILES

COC(=O)C[C@@H](C1=CC=CC=C1)NC(=O)CCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C22H24N2O3/c1-27-22(26)14-20(16-8-3-2-4-9-16)24-21(25)13-7-10-17-15-23-19-12-6-5-11-18(17)19/h2-6,8-9,11-12,15,20,23H,7,10,13-14H2,1H3,(H,24,25)/t20-/m0/s1