[(6Z)-6-(2-chloranyl-2-oxidanylidene-ethylidene)-2-(4,8-dimethyl-5-oxidanylidene-non-7-enyl)-2-methyl-oxepan-3-yl] ethanoate

Systemtic Name: [(6Z)-6-(2-chloranyl-2-oxidanylidene-ethylidene)-2-(4,8-dimethyl-5-oxidanylidene-non-7-enyl)-2-methyl-oxepan-3-yl] ethanoate Openeye Name: [(6Z)-6-(2-chloro-2-oxo-ethylidene)-2-(4,8-dimethyl-5-oxo-non-7-enyl)-2-methyl-oxepan-3-yl] acetate CAS Name: acetic acid [(6Z)-6-(2-chloro-2-oxoethylidene)-2-(4,8-dimethyl-5-oxonon-7-enyl)-2-methyl-3-oxepanyl] ester IUPAC Name: [(6Z)-6-(2-chloro-2-oxoethylidene)-2-(4,8-dimethyl-5-oxonon-7-enyl)-2-methyloxepan-3-yl] acetate Traditional Name: acetic acid [(6Z)-6-(2-chloro-2-keto-ethylidene)-2-(5-keto-4,8-dimethyl-non-7-enyl)-2-methyl-oxepan-3-yl] ester Formula: C22H33ClO5 MolecularWeight: 412.94742

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1(C(CCC(=CC(=O)Cl)CO1)OC(=O)C)C)C(=O)CC=C(C)C

Isomeric SMILES

CC(CCCC1(C(CC/C(=C/C(=O)Cl)/CO1)OC(=O)C)C)C(=O)CC=C(C)C

InChI

InChI=1S/C22H33ClO5/c1-15(2)8-10-19(25)16(3)7-6-12-22(5)20(28-17(4)24)11-9-18(14-27-22)13-21(23)26/h8,13,16,20H,6-7,9-12,14H2,1-5H3/b18-13-