[(1R,2R)-2-(3-iodanyl-4-oxidanylidene-3-prop-2-enyl-oct-7-enyl)-1,3,3-trimethyl-cyclohexyl] ethanoate

Systemtic Name: [(1R,2R)-2-(3-iodanyl-4-oxidanylidene-3-prop-2-enyl-oct-7-enyl)-1,3,3-trimethyl-cyclohexyl] ethanoate Openeye Name: [(1R,2R)-2-(3-allyl-3-iodo-4-oxo-oct-7-enyl)-1,3,3-trimethyl-cyclohexyl] acetate CAS Name: acetic acid [(1R,2R)-2-(3-iodo-4-oxo-3-prop-2-enyloct-7-enyl)-1,3,3-trimethylcyclohexyl] ester IUPAC Name: [(1R,2R)-2-(3-iodo-4-oxo-3-prop-2-enyloct-7-enyl)-1,3,3-trimethylcyclohexyl] acetate Traditional Name: acetic acid [(1R,2R)-2-(3-allyl-3-iodo-4-keto-oct-7-enyl)-1,3,3-trimethyl-cyclohexyl] ester Formula: C22H35IO3 MolecularWeight: 474.41597

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(CCCC(C1CCC(CC=C)(C(=O)CCC=C)I)(C)C)C

Isomeric SMILES

CC(=O)O[C@@]1(CCCC([C@H]1CCC(CC=C)(C(=O)CCC=C)I)(C)C)C

InChI

InChI=1S/C22H35IO3/c1-7-9-11-19(25)22(23,13-8-2)16-12-18-20(4,5)14-10-15-21(18,6)26-17(3)24/h7-8,18H,1-2,9-16H2,3-6H3/t18-,21-,22?/m1/s1