[1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(1H-indol-3-yl)propanoate

Systemtic Name: [1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(1H-indol-3-yl)propanoate Openeye Name: [1-methyl-2-(4-methylanilino)-2-oxo-ethyl] 3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)propanoic acid [1-(4-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methylanilino)-1-oxopropan-2-yl] 3-(1H-indol-3-yl)propanoate Traditional Name: 3-(1H-indol-3-yl)propionic acid [2-keto-1-methyl-2-(p-toluidino)ethyl] ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)OC(=O)CCC2=CNC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(C)OC(=O)CCC2=CNC3=CC=CC=C32

InChI

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