3-methyl-4-(3-methylphenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 3-methyl-4-(3-methylphenyl)-4-oxidanylidene-butanoic acid Openeye Name: 3-methyl-4-(m-tolyl)-4-oxo-butanoic acid CAS Name: 3-methyl-4-(3-methylphenyl)-4-oxobutanoic acid IUPAC Name: 3-methyl-4-(3-methylphenyl)-4-oxobutanoic acid Traditional Name: 4-keto-3-methyl-4-(m-tolyl)butyric acid Formula: C12H14O3 MolecularWeight: 206.23776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O3/c1-8-4-3-5-10(6-8)12(15)9(2)7-11(13)14/h3-6,9H,7H2,1-2H3,(H,13,14)