2-methyl-1-oxidanyl-5-oxidanylidene-2-phenyl-cyclohexane-1-carboxylic acid

Systemtic Name: 2-methyl-1-oxidanyl-5-oxidanylidene-2-phenyl-cyclohexane-1-carboxylic acid Openeye Name: 1-hydroxy-2-methyl-5-oxo-2-phenyl-cyclohexanecarboxylic acid CAS Name: 1-hydroxy-2-methyl-5-oxo-2-phenyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-hydroxy-2-methyl-5-oxo-2-phenylcyclohexane-1-carboxylic acid Traditional Name: 1-hydroxy-5-keto-2-methyl-2-phenyl-cyclohexanecarboxylic acid Formula: C14H16O4 MolecularWeight: 248.27444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16O4/c1-13(10-5-3-2-4-6-10)8-7-11(15)9-14(13,18)12(16)17/h2-6,18H,7-9H2,1H3,(H,16,17)