6-chloranyl-6-(3-methylphenyl)carbonyl-cyclohexa-2,4-diene-1-carboxylic acid

Systemtic Name: 6-chloranyl-6-(3-methylphenyl)carbonyl-cyclohexa-2,4-diene-1-carboxylic acid Openeye Name: 6-chloro-6-(3-methylbenzoyl)cyclohexa-2,4-diene-1-carboxylic acid CAS Name: 6-chloro-6-[(3-methylphenyl)-oxomethyl]-1-cyclohexa-2,4-dienecarboxylic acid IUPAC Name: 6-chloro-6-(3-methylbenzoyl)cyclohexa-2,4-diene-1-carboxylic acid Traditional Name: 6-chloro-6-m-toluoyl-cyclohexa-2,4-diene-1-carboxylic acid Formula: C15H13ClO3 MolecularWeight: 276.71492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C2(C=CC=CC2C(=O)O)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)C2(C=CC=CC2C(=O)O)Cl

InChI

InChI=1S/C15H13ClO3/c1-10-5-4-6-11(9-10)13(17)15(16)8-3-2-7-12(15)14(18)19/h2-9,12H,1H3,(H,18,19)