(4R)-3-[2,6-diacetyloxy-4-(2-methyloctan-2-yl)phenyl]-4-prop-1-en-2-yl-cyclohexene-1-carboxylic acid

Systemtic Name: (4R)-3-[2,6-diacetyloxy-4-(2-methyloctan-2-yl)phenyl]-4-prop-1-en-2-yl-cyclohexene-1-carboxylic acid Openeye Name: (4R)-3-[2,6-diacetoxy-4-(1,1-dimethylheptyl)phenyl]-4-isopropenyl-cyclohexene-1-carboxylic acid CAS Name: (4R)-3-[2,6-diacetyloxy-4-(2-methyloctan-2-yl)phenyl]-4-(1-methylethenyl)-1-cyclohexenecarboxylic acid IUPAC Name: (4R)-3-[2,6-diacetyloxy-4-(2-methyloctan-2-yl)phenyl]-4-prop-1-en-2-ylcyclohexene-1-carboxylic acid Traditional Name: (4R)-3-[2,6-diacetoxy-4-(1,1-dimethylheptyl)phenyl]-4-isopropenyl-cyclohexene-1-carboxylic acid Formula: C29H40O6 MolecularWeight: 484.6243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C(=C1)OC(=O)C)C2C=C(CCC2C(=C)C)C(=O)O)OC(=O)C

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C(=C1)OC(=O)C)C2C=C(CC[C@H]2C(=C)C)C(=O)O)OC(=O)C

InChI

InChI=1S/C29H40O6/c1-8-9-10-11-14-29(6,7)22-16-25(34-19(4)30)27(26(17-22)35-20(5)31)24-15-21(28(32)33)12-13-23(24)18(2)3/h15-17,23-24H,2,8-14H2,1,3-7H3,(H,32,33)/t23-,24?/m0/s1