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

Systemtic Name: (E)-7-[3-butoxy-2-[(E)-3-butoxyoct-1-enyl]-5-oxidanylidene-cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[3-butoxy-2-[(E)-3-butoxyoct-1-enyl]-5-oxo-cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[3-butoxy-2-[(E)-3-butoxyoct-1-enyl]-5-oxocyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[3-butoxy-2-[(E)-3-butoxyoct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[3-butoxy-2-[(E)-3-butoxyoct-1-enyl]-5-keto-cyclopentyl]hept-5-enoic acid Formula: C28H48O5 MolecularWeight: 464.67772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1C(CC(=O)C1CC=CCCCC(=O)O)OCCCC)OCCCC

Isomeric SMILES

CCCCCC(/C=C/C1C(CC(=O)C1C/C=C/CCCC(=O)O)OCCCC)OCCCC

InChI

InChI=1S/C28H48O5/c1-4-7-12-15-23(32-20-8-5-2)18-19-25-24(16-13-10-11-14-17-28(30)31)26(29)22-27(25)33-21-9-6-3/h10,13,18-19,23-25,27H,4-9,11-12,14-17,20-22H2,1-3H3,(H,30,31)/b13-10+,19-18+