3-methyl-2-oxidanylidene-3-phenyl-cyclohexane-1-carboxylic acid

Systemtic Name: 3-methyl-2-oxidanylidene-3-phenyl-cyclohexane-1-carboxylic acid Openeye Name: 3-methyl-2-oxo-3-phenyl-cyclohexanecarboxylic acid CAS Name: 3-methyl-2-oxo-3-phenyl-1-cyclohexanecarboxylic acid IUPAC Name: 3-methyl-2-oxo-3-phenylcyclohexane-1-carboxylic acid Traditional Name: 2-keto-3-methyl-3-phenyl-cyclohexanecarboxylic acid Formula: C14H16O3 MolecularWeight: 232.27504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16O3/c1-14(10-6-3-2-4-7-10)9-5-8-11(12(14)15)13(16)17/h2-4,6-7,11H,5,8-9H2,1H3,(H,16,17)