[(1S,3S,5S)-2,2-dimethyl-4-methylidene-3-[(3R)-3-methyl-3-oxidanyl-pent-4-enyl]-5-methylsulfonyloxy-cyclohexyl] ethanoate

Systemtic Name: [(1S,3S,5S)-2,2-dimethyl-4-methylidene-3-[(3R)-3-methyl-3-oxidanyl-pent-4-enyl]-5-methylsulfonyloxy-cyclohexyl] ethanoate Openeye Name: [(1S,3S,5S)-3-[(3R)-3-hydroxy-3-methyl-pent-4-enyl]-2,2-dimethyl-4-methylene-5-methylsulfonyloxy-cyclohexyl] acetate CAS Name: acetic acid [(1S,3S,5S)-3-[(3R)-3-hydroxy-3-methylpent-4-enyl]-2,2-dimethyl-4-methylene-5-methylsulfonyloxycyclohexyl] ester IUPAC Name: [(1S,3S,5S)-3-[(3R)-3-hydroxy-3-methylpent-4-enyl]-2,2-dimethyl-4-methylidene-5-methylsulfonyloxycyclohexyl] acetate Traditional Name: acetic acid [(1S,3S,5S)-3-[(3R)-3-hydroxy-3-methyl-pent-4-enyl]-2,2-dimethyl-4-methylene-5-methylsulfonyloxy-cyclohexyl] ester Formula: C18H30O6S MolecularWeight: 374.4922

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(C(=C)C(C1(C)C)CCC(C)(C=C)O)OS(=O)(=O)C

Isomeric SMILES

CC(=O)O[C@H]1C[C@@H](C(=C)[C@H](C1(C)C)CC[C@](C)(C=C)O)OS(=O)(=O)C

InChI

InChI=1S/C18H30O6S/c1-8-18(6,20)10-9-14-12(2)15(24-25(7,21)22)11-16(17(14,4)5)23-13(3)19/h8,14-16,20H,1-2,9-11H2,3-7H3/t14-,15+,16+,18+/m1/s1