3-methoxy-4-[(1Z)-2-methyl-1-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]benzoic acid

Systemtic Name: 3-methoxy-4-[(1Z)-2-methyl-1-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]benzoic acid Openeye Name: 3-methoxy-4-[(1Z)-2-methyl-1-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]benzoic acid CAS Name: 3-methoxy-4-[(1Z)-2-methyl-1-(2,6,6-trimethyl-1-cyclohexenyl)buta-1,3-dienyl]benzoic acid IUPAC Name: 3-methoxy-4-[(1Z)-2-methyl-1-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]benzoic acid Traditional Name: 3-methoxy-4-[(1Z)-2-methyl-1-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]benzoic acid Formula: C22H28O3 MolecularWeight: 340.45592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)C(=C(C)C=C)C2=C(C=C(C=C2)C(=O)O)OC

Isomeric SMILES

CC1=C(C(CCC1)(C)C)/C(=C(\C)/C=C)/C2=C(C=C(C=C2)C(=O)O)OC

InChI

InChI=1S/C22H28O3/c1-7-14(2)19(20-15(3)9-8-12-22(20,4)5)17-11-10-16(21(23)24)13-18(17)25-6/h7,10-11,13H,1,8-9,12H2,2-6H3,(H,23,24)/b19-14+