methyl (2S)-3-(1H-indol-3-yl)-2-[2-(4-methylphenyl)ethanoylamino]propanoate

Systemtic Name: methyl (2S)-3-(1H-indol-3-yl)-2-[2-(4-methylphenyl)ethanoylamino]propanoate Openeye Name: methyl (2S)-3-(1H-indol-3-yl)-2-[[2-(p-tolyl)acetyl]amino]propanoate CAS Name: (2S)-3-(1H-indol-3-yl)-2-[[2-(4-methylphenyl)-1-oxoethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(1H-indol-3-yl)-2-[[2-(4-methylphenyl)acetyl]amino]propanoate Traditional Name: (2S)-3-(1H-indol-3-yl)-2-[[2-(p-tolyl)acetyl]amino]propionic acid methyl ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)CC(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C21H22N2O3/c1-14-7-9-15(10-8-14)11-20(24)23-19(21(25)26-2)12-16-13-22-18-6-4-3-5-17(16)18/h3-10,13,19,22H,11-12H2,1-2H3,(H,23,24)/t19-/m0/s1