(phenylmethyl) 6-(3-methylphenyl)-3,6-bis(oxidanylidene)hexanoate

Systemtic Name: (phenylmethyl) 6-(3-methylphenyl)-3,6-bis(oxidanylidene)hexanoate Openeye Name: benzyl 6-(m-tolyl)-3,6-dioxo-hexanoate CAS Name: 6-(3-methylphenyl)-3,6-dioxohexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 6-(3-methylphenyl)-3,6-dioxohexanoate Traditional Name: 3,6-diketo-6-(m-tolyl)hexanoic acid benzyl ester Formula: C20H20O4 MolecularWeight: 324.3704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)CCC(=O)CC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)CCC(=O)CC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H20O4/c1-15-6-5-9-17(12-15)19(22)11-10-18(21)13-20(23)24-14-16-7-3-2-4-8-16/h2-9,12H,10-11,13-14H2,1H3