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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1CCC(=O)C1CC=CCCC(C(=O)O)OCCCC)OCCC

Isomeric SMILES

CCCCCC(/C=C/C1CCC(=O)C1C/C=C/CCC(C(=O)O)OCCCC)OCCC

InChI

InChI=1S/C27H46O5/c1-4-7-10-13-23(31-20-6-3)18-16-22-17-19-25(28)24(22)14-11-9-12-15-26(27(29)30)32-21-8-5-2/h9,11,16,18,22-24,26H,4-8,10,12-15,17,19-21H2,1-3H3,(H,29,30)/b11-9+,18-16+