1-(3-chlorophenyl)-4-oxidanylidene-cyclohexane-1-carboxylic acid

Systemtic Name: 1-(3-chlorophenyl)-4-oxidanylidene-cyclohexane-1-carboxylic acid Openeye Name: 1-(3-chlorophenyl)-4-oxo-cyclohexanecarboxylic acid CAS Name: 1-(3-chlorophenyl)-4-oxo-1-cyclohexanecarboxylic acid IUPAC Name: 1-(3-chlorophenyl)-4-oxocyclohexane-1-carboxylic acid Traditional Name: 1-(3-chlorophenyl)-4-keto-cyclohexanecarboxylic acid Formula: C13H13ClO3 MolecularWeight: 252.69352

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1=O)(C2=CC(=CC=C2)Cl)C(=O)O

Isomeric SMILES

C1CC(CCC1=O)(C2=CC(=CC=C2)Cl)C(=O)O

InChI

InChI=1S/C13H13ClO3/c14-10-3-1-2-9(8-10)13(12(16)17)6-4-11(15)5-7-13/h1-3,8H,4-7H2,(H,16,17)