methyl 4-(4-ethoxyphenyl)-2-(1H-indol-3-yl)-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-(4-ethoxyphenyl)-2-(1H-indol-3-yl)-4-oxidanylidene-butanoate Openeye Name: methyl 4-(4-ethoxyphenyl)-2-(1H-indol-3-yl)-4-oxo-butanoate CAS Name: 4-(4-ethoxyphenyl)-2-(1H-indol-3-yl)-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(4-ethoxyphenyl)-2-(1H-indol-3-yl)-4-oxobutanoate Traditional Name: 2-(1H-indol-3-yl)-4-keto-4-p-phenetyl-butyric acid methyl ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CC(C2=CNC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CC(C2=CNC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C21H21NO4/c1-3-26-15-10-8-14(9-11-15)20(23)12-17(21(24)25-2)18-13-22-19-7-5-4-6-16(18)19/h4-11,13,17,22H,3,12H2,1-2H3