[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 3-(1H-indol-3-yl)propanoate

Systemtic Name: [2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 3-(1H-indol-3-yl)propanoate Openeye Name: [2-(3,4-dimethylanilino)-2-oxo-ethyl] 3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)propanoic acid [2-(3,4-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylanilino)-2-oxoethyl] 3-(1H-indol-3-yl)propanoate Traditional Name: 3-(1H-indol-3-yl)propionic acid [2-(3,4-dimethylanilino)-2-keto-ethyl] ester Formula: C21H22N2O3 MolecularWeight: 350.41098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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