1-(1-oxidanyl-1-oxidanylidene-propan-2-yl)-4-phenyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 1-(1-oxidanyl-1-oxidanylidene-propan-2-yl)-4-phenyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: 1-(2-hydroxy-1-methyl-2-oxo-ethyl)-4-phenyl-cyclohex-3-ene-1-carboxylic acid CAS Name: 1-(1-hydroxy-1-oxopropan-2-yl)-4-phenyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: 1-(1-hydroxy-1-oxopropan-2-yl)-4-phenylcyclohex-3-ene-1-carboxylic acid Traditional Name: 1-(2-hydroxy-2-keto-1-methyl-ethyl)-4-phenyl-cyclohex-3-ene-1-carboxylic acid Formula: C16H18O4 MolecularWeight: 274.31172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18O4/c1-11(14(17)18)16(15(19)20)9-7-13(8-10-16)12-5-3-2-4-6-12/h2-7,11H,8-10H2,1H3,(H,17,18)(H,19,20)