(E)-2-butoxy-7-[2-[(E)-oct-1-enyl]-5-oxidanylidene-3-propoxy-cyclopentyl]hept-5-enoic acid

Systemtic Name: (E)-2-butoxy-7-[2-[(E)-oct-1-enyl]-5-oxidanylidene-3-propoxy-cyclopentyl]hept-5-enoic acid Openeye Name: (E)-2-butoxy-7-[2-[(E)-oct-1-enyl]-5-oxo-3-propoxy-cyclopentyl]hept-5-enoic acid CAS Name: (E)-2-butoxy-7-[2-[(E)-oct-1-enyl]-5-oxo-3-propoxycyclopentyl]-5-heptenoic acid IUPAC Name: (E)-2-butoxy-7-[2-[(E)-oct-1-enyl]-5-oxo-3-propoxycyclopentyl]hept-5-enoic acid Traditional Name: (E)-2-butoxy-7-[5-keto-2-[(E)-oct-1-enyl]-3-propoxy-cyclopentyl]hept-5-enoic acid Formula: C27H46O5 MolecularWeight: 450.65114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1C(CC(=O)C1CC=CCCC(C(=O)O)OCCCC)OCCC

Isomeric SMILES

CCCCCC/C=C/C1C(CC(=O)C1C/C=C/CCC(C(=O)O)OCCCC)OCCC

InChI

InChI=1S/C27H46O5/c1-4-7-9-10-11-13-17-23-22(24(28)21-26(23)31-19-6-3)16-14-12-15-18-25(27(29)30)32-20-8-5-2/h12-14,17,22-23,25-26H,4-11,15-16,18-21H2,1-3H3,(H,29,30)/b14-12+,17-13+