3-methyl-6-(4-methylphenyl)carbonyl-phthalate

Systemtic Name: 3-methyl-6-(4-methylphenyl)carbonyl-phthalate Openeye Name: 3-methyl-6-(4-methylbenzoyl)phthalate CAS Name: 3-methyl-6-[(4-methylphenyl)-oxomethyl]phthalate IUPAC Name: 3-methyl-6-(4-methylbenzoyl)phthalate Traditional Name: 3-methyl-6-p-toluoyl-phthalate Formula: C17H12O5-2 MolecularWeight: 296.27418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(C(=C(C=C2)C)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(C(=C(C=C2)C)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C17H14O5/c1-9-3-6-11(7-4-9)15(18)12-8-5-10(2)13(16(19)20)14(12)17(21)22/h3-8H,1-2H3,(H,19,20)(H,21,22)/p-2