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

Systemtic Name: phenyl 3-methoxy-4-[(1Z)-2-methyl-1-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]benzoate Openeye Name: phenyl 3-methoxy-4-[(1Z)-2-methyl-1-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]benzoate CAS Name: 3-methoxy-4-[(1Z)-2-methyl-1-(2,6,6-trimethyl-1-cyclohexenyl)buta-1,3-dienyl]benzoic acid phenyl ester IUPAC Name: phenyl 3-methoxy-4-[(1Z)-2-methyl-1-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]benzoate Traditional Name: 3-methoxy-4-[(1Z)-2-methyl-1-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]benzoic acid phenyl ester Formula: C28H32O3 MolecularWeight: 416.55188

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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)OC3=CC=CC=C3)OC

Isomeric SMILES

CC1=C(C(CCC1)(C)C)/C(=C(\C)/C=C)/C2=C(C=C(C=C2)C(=O)OC3=CC=CC=C3)OC

InChI

InChI=1S/C28H32O3/c1-7-19(2)25(26-20(3)12-11-17-28(26,4)5)23-16-15-21(18-24(23)30-6)27(29)31-22-13-9-8-10-14-22/h7-10,13-16,18H,1,11-12,17H2,2-6H3/b25-19+