3,6-dimethyl-2-(phenylcarbonyl)benzoic acid

Systemtic Name: 3,6-dimethyl-2-(phenylcarbonyl)benzoic acid Openeye Name: 2-benzoyl-3,6-dimethyl-benzoic acid CAS Name: 2-benzoyl-3,6-dimethylbenzoic acid IUPAC Name: 2-benzoyl-3,6-dimethylbenzoic acid Traditional Name: 2-benzoyl-3,6-dimethyl-benzoic acid Formula: C16H14O3 MolecularWeight: 254.28056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14O3/c1-10-8-9-11(2)14(16(18)19)13(10)15(17)12-6-4-3-5-7-12/h3-9H,1-2H3,(H,18,19)