dimethyl 2-[1-(4-chlorophenyl)-1,4-bis(oxidanylidene)-4-phenyl-butan-2-yl]propanedioate

Systemtic Name: dimethyl 2-[1-(4-chlorophenyl)-1,4-bis(oxidanylidene)-4-phenyl-butan-2-yl]propanedioate Openeye Name: dimethyl 2-[1-(4-chlorobenzoyl)-3-oxo-3-phenyl-propyl]propanedioate CAS Name: 2-[1-(4-chlorophenyl)-1,4-dioxo-4-phenylbutan-2-yl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[1-(4-chlorophenyl)-1,4-dioxo-4-phenylbutan-2-yl]propanedioate Traditional Name: 2-[1-(4-chlorobenzoyl)-3-keto-3-phenyl-propyl]malonic acid dimethyl ester Formula: C21H19ClO6 MolecularWeight: 402.82496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClO6/c1-27-20(25)18(21(26)28-2)16(12-17(23)13-6-4-3-5-7-13)19(24)14-8-10-15(22)11-9-14/h3-11,16,18H,12H2,1-2H3