dimethyl 2-[2-(4-chlorophenyl)-4-oxidanylidene-4-phenyl-butyl]propanedioate

Systemtic Name: dimethyl 2-[2-(4-chlorophenyl)-4-oxidanylidene-4-phenyl-butyl]propanedioate Openeye Name: dimethyl 2-[2-(4-chlorophenyl)-4-oxo-4-phenyl-butyl]propanedioate CAS Name: 2-[2-(4-chlorophenyl)-4-oxo-4-phenylbutyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[2-(4-chlorophenyl)-4-oxo-4-phenylbutyl]propanedioate Traditional Name: 2-[2-(4-chlorophenyl)-4-keto-4-phenyl-butyl]malonic acid dimethyl ester Formula: C21H21ClO5 MolecularWeight: 388.84144

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(CC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)Cl)C(=O)OC

Isomeric SMILES

COC(=O)C(CC(CC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)Cl)C(=O)OC

InChI

InChI=1S/C21H21ClO5/c1-26-20(24)18(21(25)27-2)12-16(14-8-10-17(22)11-9-14)13-19(23)15-6-4-3-5-7-15/h3-11,16,18H,12-13H2,1-2H3