ethyl 4-[1-(4-cyanophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]-2-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[1-(4-cyanophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]-2-oxidanylidene-butanoate Openeye Name: ethyl 4-[1-(4-cyanobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-2-oxo-butanoate CAS Name: 4-[1-[(4-cyanophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]-2-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[1-(4-cyanobenzoyl)-5-methoxy-2-methylindol-3-yl]-2-oxobutanoate Traditional Name: 4-[1-(4-cyanobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-2-keto-butyric acid ethyl ester Formula: C24H22N2O5 MolecularWeight: 418.44188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)CCC1=C(N(C2=C1C=C(C=C2)OC)C(=O)C3=CC=C(C=C3)C#N)C

Isomeric SMILES

CCOC(=O)C(=O)CCC1=C(N(C2=C1C=C(C=C2)OC)C(=O)C3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C24H22N2O5/c1-4-31-24(29)22(27)12-10-19-15(2)26(21-11-9-18(30-3)13-20(19)21)23(28)17-7-5-16(14-25)6-8-17/h5-9,11,13H,4,10,12H2,1-3H3