dimethyl 2-(4-methylphenyl)carbonyl-2-(3-oxidanylidenebutyl)propanedioate

Systemtic Name: dimethyl 2-(4-methylphenyl)carbonyl-2-(3-oxidanylidenebutyl)propanedioate Openeye Name: dimethyl 2-(4-methylbenzoyl)-2-(3-oxobutyl)propanedioate CAS Name: 2-[(4-methylphenyl)-oxomethyl]-2-(3-oxobutyl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(4-methylbenzoyl)-2-(3-oxobutyl)propanedioate Traditional Name: 2-(3-ketobutyl)-2-p-toluoyl-malonic acid dimethyl ester Formula: C17H20O6 MolecularWeight: 320.3371

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(CCC(=O)C)(C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(CCC(=O)C)(C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H20O6/c1-11-5-7-13(8-6-11)14(19)17(15(20)22-3,16(21)23-4)10-9-12(2)18/h5-8H,9-10H2,1-4H3