ethyl 4-[3-(2-chloranyl-2-oxidanylidene-ethanoyl)-2-methyl-1-(phenylmethyl)indol-5-yl]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[3-(2-chloranyl-2-oxidanylidene-ethanoyl)-2-methyl-1-(phenylmethyl)indol-5-yl]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[1-benzyl-3-(2-chloro-2-oxo-acetyl)-2-methyl-indol-5-yl]-4-oxo-butanoate CAS Name: 4-[3-(2-chloro-1,2-dioxoethyl)-2-methyl-1-(phenylmethyl)-5-indolyl]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[1-benzyl-3-(2-chloro-2-oxoacetyl)-2-methylindol-5-yl]-4-oxobutanoate Traditional Name: 4-[1-benzyl-3-(2-chloro-2-keto-acetyl)-2-methyl-indol-5-yl]-4-keto-butyric acid ethyl ester Formula: C24H22ClNO5 MolecularWeight: 439.88818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)C1=CC2=C(C=C1)N(C(=C2C(=O)C(=O)Cl)C)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CCC(=O)C1=CC2=C(C=C1)N(C(=C2C(=O)C(=O)Cl)C)CC3=CC=CC=C3

InChI

InChI=1S/C24H22ClNO5/c1-3-31-21(28)12-11-20(27)17-9-10-19-18(13-17)22(23(29)24(25)30)15(2)26(19)14-16-7-5-4-6-8-16/h4-10,13H,3,11-12,14H2,1-2H3