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

Systemtic Name: 2-[6-acetyloxy-7-(4,8-dimethyl-5-oxidanylidene-non-7-enyl)-7-methyl-oxepan-3-yl]ethyl ethanoate Openeye Name: 2-[6-acetoxy-7-(4,8-dimethyl-5-oxo-non-7-enyl)-7-methyl-oxepan-3-yl]ethyl acetate CAS Name: acetic acid 2-[6-acetyloxy-7-(4,8-dimethyl-5-oxonon-7-enyl)-7-methyl-3-oxepanyl]ethyl ester IUPAC Name: 2-[6-acetyloxy-7-(4,8-dimethyl-5-oxonon-7-enyl)-7-methyloxepan-3-yl]ethyl acetate Traditional Name: acetic acid 2-[6-acetoxy-7-(5-keto-4,8-dimethyl-non-7-enyl)-7-methyl-oxepan-3-yl]ethyl ester Formula: C24H40O6 MolecularWeight: 424.5708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H40O6/c1-17(2)9-11-22(27)18(3)8-7-14-24(6)23(30-20(5)26)12-10-21(16-29-24)13-15-28-19(4)25/h9,18,21,23H,7-8,10-16H2,1-6H3