(E)-10-[5,6-dihexyl-2-(8-oxidanyl-8-oxidanylidene-octyl)cyclohex-3-en-1-yl]dec-9-enoic acid

Systemtic Name: (E)-10-[5,6-dihexyl-2-(8-oxidanyl-8-oxidanylidene-octyl)cyclohex-3-en-1-yl]dec-9-enoic acid Openeye Name: (E)-10-[5,6-dihexyl-2-(8-hydroxy-8-oxo-octyl)cyclohex-3-en-1-yl]dec-9-enoic acid CAS Name: (E)-10-[5,6-dihexyl-2-(8-hydroxy-8-oxooctyl)-1-cyclohex-3-enyl]-9-decenoic acid IUPAC Name: (E)-10-[5,6-dihexyl-2-(8-hydroxy-8-oxooctyl)cyclohex-3-en-1-yl]dec-9-enoic acid Traditional Name: (E)-10-[5,6-dihexyl-2-(8-hydroxy-8-keto-octyl)cyclohex-3-en-1-yl]dec-9-enoic acid Formula: C36H64O4 MolecularWeight: 560.89096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C=CC(C(C1CCCCCC)C=CCCCCCCCC(=O)O)CCCCCCCC(=O)O

Isomeric SMILES

CCCCCCC1C=CC(C(C1CCCCCC)/C=C/CCCCCCCC(=O)O)CCCCCCCC(=O)O

InChI

InChI=1S/C36H64O4/c1-3-5-7-17-23-31-29-30-32(24-18-13-12-16-22-28-36(39)40)34(33(31)25-19-8-6-4-2)26-20-14-10-9-11-15-21-27-35(37)38/h20,26,29-34H,3-19,21-25,27-28H2,1-2H3,(H,37,38)(H,39,40)/b26-20+