[2-(4-methylphenyl)-2-oxidanylidene-ethyl] 4-(1H-indol-3-yl)butanoate

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-ethyl] 4-(1H-indol-3-yl)butanoate Openeye Name: [2-oxo-2-(p-tolyl)ethyl] 4-(1H-indol-3-yl)butanoate CAS Name: 4-(1H-indol-3-yl)butanoic acid [2-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] 4-(1H-indol-3-yl)butanoate Traditional Name: 4-(1H-indol-3-yl)butyric acid [2-keto-2-(p-tolyl)ethyl] ester Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)COC(=O)CCCC2=CNC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)COC(=O)CCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C21H21NO3/c1-15-9-11-16(12-10-15)20(23)14-25-21(24)8-4-5-17-13-22-19-7-3-2-6-18(17)19/h2-3,6-7,9-13,22H,4-5,8,14H2,1H3