(E)-7-[2-oxidanylidene-5-[(E)-3-oxidanyloct-1-en-6-ynyl]cyclopent-3-en-1-yl]hept-5-enoic acid

Systemtic Name: (E)-7-[2-oxidanylidene-5-[(E)-3-oxidanyloct-1-en-6-ynyl]cyclopent-3-en-1-yl]hept-5-enoic acid Openeye Name: (E)-7-[2-[(E)-3-hydroxyoct-1-en-6-ynyl]-5-oxo-cyclopent-3-en-1-yl]hept-5-enoic acid CAS Name: (E)-7-[2-[(E)-3-hydroxyoct-1-en-6-ynyl]-5-oxo-1-cyclopent-3-enyl]-5-heptenoic acid IUPAC Name: (E)-7-[2-[(E)-3-hydroxyoct-1-en-6-ynyl]-5-oxocyclopent-3-en-1-yl]hept-5-enoic acid Traditional Name: (E)-7-[2-[(E)-3-hydroxyoct-1-en-6-ynyl]-5-keto-cyclopent-3-en-1-yl]hept-5-enoic acid Formula: C20H26O4 MolecularWeight: 330.41804

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCCC(C=CC1C=CC(=O)C1CC=CCCCC(=O)O)O

Isomeric SMILES

CC#CCCC(/C=C/C1C=CC(=O)C1C/C=C/CCCC(=O)O)O

InChI

InChI=1S/C20H26O4/c1-2-3-6-9-17(21)14-12-16-13-15-19(22)18(16)10-7-4-5-8-11-20(23)24/h4,7,12-18,21H,5-6,8-11H2,1H3,(H,23,24)/b7-4+,14-12+