methyl (4E,6E)-3,7-dimethyl-3-oxidanyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-4,6-dienoate

Systemtic Name: methyl (4E,6E)-3,7-dimethyl-3-oxidanyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-4,6-dienoate Openeye Name: methyl (4E,6E)-3-hydroxy-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-4,6-dienoate CAS Name: (4E,6E)-3-hydroxy-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-4,6-dienoic acid methyl ester IUPAC Name: methyl (4E,6E)-3-hydroxy-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-4,6-dienoate Traditional Name: (4E,6E)-3-hydroxy-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-4,6-dienoic acid methyl ester Formula: C21H34O3 MolecularWeight: 334.49286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)CCC(=CC=CC(C)(CC(=O)OC)O)C

Isomeric SMILES

CC1=C(C(CCC1)(C)C)CC/C(=C/C=C/C(C)(CC(=O)OC)O)/C

InChI

InChI=1S/C21H34O3/c1-16(9-7-14-21(5,23)15-19(22)24-6)11-12-18-17(2)10-8-13-20(18,3)4/h7,9,14,23H,8,10-13,15H2,1-6H3/b14-7+,16-9+