7-[3-oxidanylidene-1-[(E)-3-oxidanyloct-1-enyl]cyclohexyl]heptanoic acid

Systemtic Name: 7-[3-oxidanylidene-1-[(E)-3-oxidanyloct-1-enyl]cyclohexyl]heptanoic acid Openeye Name: 7-[1-[(E)-3-hydroxyoct-1-enyl]-3-oxo-cyclohexyl]heptanoic acid CAS Name: 7-[1-[(E)-3-hydroxyoct-1-enyl]-3-oxocyclohexyl]heptanoic acid IUPAC Name: 7-[1-[(E)-3-hydroxyoct-1-enyl]-3-oxocyclohexyl]heptanoic acid Traditional Name: 7-[1-[(E)-3-hydroxyoct-1-enyl]-3-keto-cyclohexyl]enanthic acid Formula: C21H36O4 MolecularWeight: 352.50814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1(CCCC(=O)C1)CCCCCCC(=O)O)O

Isomeric SMILES

CCCCCC(/C=C/C1(CCCC(=O)C1)CCCCCCC(=O)O)O

InChI

InChI=1S/C21H36O4/c1-2-3-6-10-18(22)13-16-21(15-9-11-19(23)17-21)14-8-5-4-7-12-20(24)25/h13,16,18,22H,2-12,14-15,17H2,1H3,(H,24,25)/b16-13+