4-oxidanylidene-1-(phenylmethyl)cyclohexane-1-carboxylic acid

Systemtic Name: 4-oxidanylidene-1-(phenylmethyl)cyclohexane-1-carboxylic acid Openeye Name: 1-benzyl-4-oxo-cyclohexanecarboxylic acid CAS Name: 4-oxo-1-(phenylmethyl)-1-cyclohexanecarboxylic acid IUPAC Name: 1-benzyl-4-oxocyclohexane-1-carboxylic acid Traditional Name: 1-benzyl-4-keto-cyclohexanecarboxylic acid Formula: C14H16O3 MolecularWeight: 232.27504

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1=O)(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CC(CCC1=O)(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C14H16O3/c15-12-6-8-14(9-7-12,13(16)17)10-11-4-2-1-3-5-11/h1-5H,6-10H2,(H,16,17)