4-[(4-prop-1-en-2-ylcyclohexen-1-yl)carbonyloxymethoxycarbonyl]benzoic acid

Systemtic Name: 4-[(4-prop-1-en-2-ylcyclohexen-1-yl)carbonyloxymethoxycarbonyl]benzoic acid Openeye Name: 4-[(4-isopropenylcyclohexene-1-carbonyl)oxymethoxycarbonyl]benzoic acid CAS Name: 4-[[[4-(1-methylethenyl)-1-cyclohexenyl]-oxomethoxy]methoxy-oxomethyl]benzoic acid IUPAC Name: 4-[(4-prop-1-en-2-ylcyclohexene-1-carbonyl)oxymethoxycarbonyl]benzoic acid Traditional Name: 4-[(4-isopropenylcyclohexene-1-carbonyl)oxymethoxycarbonyl]benzoic acid Formula: C19H20O6 MolecularWeight: 344.3585

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1CCC(=CC1)C(=O)OCOC(=O)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC(=C)C1CCC(=CC1)C(=O)OCOC(=O)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C19H20O6/c1-12(2)13-3-7-15(8-4-13)18(22)24-11-25-19(23)16-9-5-14(6-10-16)17(20)21/h5-7,9-10,13H,1,3-4,8,11H2,2H3,(H,20,21)