1-(3,4-dimethoxyphenyl)-4-oxidanylidene-cyclohexane-1-carboxylic acid

Systemtic Name: 1-(3,4-dimethoxyphenyl)-4-oxidanylidene-cyclohexane-1-carboxylic acid Openeye Name: 1-(3,4-dimethoxyphenyl)-4-oxo-cyclohexanecarboxylic acid CAS Name: 1-(3,4-dimethoxyphenyl)-4-oxo-1-cyclohexanecarboxylic acid IUPAC Name: 1-(3,4-dimethoxyphenyl)-4-oxocyclohexane-1-carboxylic acid Traditional Name: 1-(3,4-dimethoxyphenyl)-4-keto-cyclohexanecarboxylic acid Formula: C15H18O5 MolecularWeight: 278.30042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCC(=O)CC2)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCC(=O)CC2)C(=O)O)OC

InChI

InChI=1S/C15H18O5/c1-19-12-4-3-10(9-13(12)20-2)15(14(17)18)7-5-11(16)6-8-15/h3-4,9H,5-8H2,1-2H3,(H,17,18)