[9-[(6Z)-6-(2-chloranyl-2-oxidanylidene-ethylidene)-2-methyl-3-oxidanylidene-oxepan-2-yl]-2,6-dimethyl-non-2-en-5-yl] ethanoate

Systemtic Name: [9-[(6Z)-6-(2-chloranyl-2-oxidanylidene-ethylidene)-2-methyl-3-oxidanylidene-oxepan-2-yl]-2,6-dimethyl-non-2-en-5-yl] ethanoate Openeye Name: [1-[4-[(6Z)-6-(2-chloro-2-oxo-ethylidene)-2-methyl-3-oxo-oxepan-2-yl]-1-methyl-butyl]-4-methyl-pent-3-enyl] acetate CAS Name: acetic acid [9-[(6Z)-6-(2-chloro-2-oxoethylidene)-2-methyl-3-oxo-2-oxepanyl]-2,6-dimethylnon-2-en-5-yl] ester IUPAC Name: [9-[(6Z)-6-(2-chloro-2-oxoethylidene)-2-methyl-3-oxooxepan-2-yl]-2,6-dimethylnon-2-en-5-yl] acetate Traditional Name: acetic acid [1-[4-[(6Z)-6-(2-chloro-2-keto-ethylidene)-3-keto-2-methyl-oxepan-2-yl]-1-methyl-butyl]-4-methyl-pent-3-enyl] ester Formula: C22H33ClO5 MolecularWeight: 412.94742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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