[(E)-8-[2-[(E)-5-methylnon-1-enyl]cyclopentyl]-2,2-bis(oxidanyl)oct-6-enyl] ethanoate

Systemtic Name: [(E)-8-[2-[(E)-5-methylnon-1-enyl]cyclopentyl]-2,2-bis(oxidanyl)oct-6-enyl] ethanoate Openeye Name: [(E)-2,2-dihydroxy-8-[2-[(E)-5-methylnon-1-enyl]cyclopentyl]oct-6-enyl] acetate CAS Name: acetic acid [(E)-2,2-dihydroxy-8-[2-[(E)-5-methylnon-1-enyl]cyclopentyl]oct-6-enyl] ester IUPAC Name: [(E)-2,2-dihydroxy-8-[2-[(E)-5-methylnon-1-enyl]cyclopentyl]oct-6-enyl] acetate Traditional Name: acetic acid [(E)-2,2-dihydroxy-8-[2-[(E)-5-methylnon-1-enyl]cyclopentyl]oct-6-enyl] ester Formula: C25H44O4 MolecularWeight: 408.61446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)CCC=CC1CCCC1CC=CCCCC(COC(=O)C)(O)O

Isomeric SMILES

CCCCC(C)CC/C=C/C1CCCC1C/C=C/CCCC(COC(=O)C)(O)O

InChI

InChI=1S/C25H44O4/c1-4-5-13-21(2)14-9-10-16-24-18-12-17-23(24)15-8-6-7-11-19-25(27,28)20-29-22(3)26/h6,8,10,16,21,23-24,27-28H,4-5,7,9,11-15,17-20H2,1-3H3/b8-6+,16-10+