methyl 4-[[5-chloranyl-4-[(4-chlorophenyl)-cyano-methyl]-2-methyl-phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[[5-chloranyl-4-[(4-chlorophenyl)-cyano-methyl]-2-methyl-phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[5-chloro-4-[(4-chlorophenyl)-cyano-methyl]-2-methyl-anilino]-4-oxo-butanoate CAS Name: 4-[5-chloro-4-[(4-chlorophenyl)-cyanomethyl]-2-methylanilino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[5-chloro-4-[(4-chlorophenyl)-cyanomethyl]-2-methylanilino]-4-oxobutanoate Traditional Name: 4-[5-chloro-4-[(4-chlorophenyl)-cyano-methyl]-2-methyl-anilino]-4-keto-butyric acid methyl ester Formula: C20H18Cl2N2O3 MolecularWeight: 405.27452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)CCC(=O)OC)Cl)C(C#N)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)CCC(=O)OC)Cl)C(C#N)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H18Cl2N2O3/c1-12-9-15(16(11-23)13-3-5-14(21)6-4-13)17(22)10-18(12)24-19(25)7-8-20(26)27-2/h3-6,9-10,16H,7-8H2,1-2H3,(H,24,25)