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

Systemtic Name: ethyl 4-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]-2-cyano-3-oxidanylidene-butanoate Openeye Name: ethyl 4-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-2-cyano-3-oxo-butanoate CAS Name: 4-[1-[(4-chlorophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]-2-cyano-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]-2-cyano-3-oxobutanoate Traditional Name: 4-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-2-cyano-3-keto-butyric acid ethyl ester Formula: C24H21ClN2O5 MolecularWeight: 452.88694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(=O)CC1=C(N(C2=C1C=C(C=C2)OC)C(=O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)C(C#N)C(=O)CC1=C(N(C2=C1C=C(C=C2)OC)C(=O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C24H21ClN2O5/c1-4-32-24(30)20(13-26)22(28)12-18-14(2)27(21-10-9-17(31-3)11-19(18)21)23(29)15-5-7-16(25)8-6-15/h5-11,20H,4,12H2,1-3H3