methyl 7-[(1S,2R)-2-[(E)-oct-1-enyl]-1-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoate

Systemtic Name: methyl 7-[(1S,2R)-2-[(E)-oct-1-enyl]-1-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoate Openeye Name: methyl 7-[(1S,2R)-1-hydroxy-2-[(E)-oct-1-enyl]-5-oxo-cyclopentyl]heptanoate CAS Name: 7-[(1S,2R)-1-hydroxy-2-[(E)-oct-1-enyl]-5-oxocyclopentyl]heptanoic acid methyl ester IUPAC Name: methyl 7-[(1S,2R)-1-hydroxy-2-[(E)-oct-1-enyl]-5-oxocyclopentyl]heptanoate Traditional Name: 7-[(1S,5R)-1-hydroxy-2-keto-5-[(E)-oct-1-enyl]cyclopentyl]enanthic acid methyl ester Formula: C21H36O4 MolecularWeight: 352.50814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1CCC(=O)C1(CCCCCCC(=O)OC)O

Isomeric SMILES

CCCCCC/C=C/[C@H]1CCC(=O)[C@@]1(CCCCCCC(=O)OC)O

InChI

InChI=1S/C21H36O4/c1-3-4-5-6-7-10-13-18-15-16-19(22)21(18,24)17-12-9-8-11-14-20(23)25-2/h10,13,18,24H,3-9,11-12,14-17H2,1-2H3/b13-10+/t18-,21-/m0/s1