[2-[(3,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-(1H-indol-3-yl)propanoate

Systemtic Name: [2-[(3,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-(1H-indol-3-yl)propanoate Openeye Name: [2-(3,5-dimethoxyanilino)-2-oxo-ethyl] 3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)propanoic acid [2-(3,5-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethoxyanilino)-2-oxoethyl] 3-(1H-indol-3-yl)propanoate Traditional Name: 3-(1H-indol-3-yl)propionic acid [2-(3,5-dimethoxyanilino)-2-keto-ethyl] ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)COC(=O)CCC2=CNC3=CC=CC=C32)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)COC(=O)CCC2=CNC3=CC=CC=C32)OC

InChI

InChI=1S/C21H22N2O5/c1-26-16-9-15(10-17(11-16)27-2)23-20(24)13-28-21(25)8-7-14-12-22-19-6-4-3-5-18(14)19/h3-6,9-12,22H,7-8,13H2,1-2H3,(H,23,24)