methyl 7-[5-oxidanylidene-2-[(E,3S)-3-oxidanyloct-1-enyl]cyclopenten-1-yl]heptanoate

Systemtic Name: methyl 7-[5-oxidanylidene-2-[(E,3S)-3-oxidanyloct-1-enyl]cyclopenten-1-yl]heptanoate Openeye Name: methyl 7-[2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxo-cyclopenten-1-yl]heptanoate CAS Name: 7-[2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxo-1-cyclopentenyl]heptanoic acid methyl ester IUPAC Name: methyl 7-[2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopenten-1-yl]heptanoate Traditional Name: 7-[2-[(E,3S)-3-hydroxyoct-1-enyl]-5-keto-cyclopenten-1-yl]enanthic acid methyl ester Formula: C21H34O4 MolecularWeight: 350.49226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1=C(C(=O)CC1)CCCCCCC(=O)OC)O

Isomeric SMILES

CCCCC[C@@H](/C=C/C1=C(C(=O)CC1)CCCCCCC(=O)OC)O

InChI

InChI=1S/C21H34O4/c1-3-4-7-10-18(22)15-13-17-14-16-20(23)19(17)11-8-5-6-9-12-21(24)25-2/h13,15,18,22H,3-12,14,16H2,1-2H3/b15-13+/t18-/m0/s1