(E)-7-[4-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]cyclopent-2-en-1-yl]hept-2-enoic acid

Systemtic Name: (E)-7-[4-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]cyclopent-2-en-1-yl]hept-2-enoic acid Openeye Name: (E)-7-[5-[(E)-3-hydroxyoct-1-enyl]-4-oxo-cyclopent-2-en-1-yl]hept-2-enoic acid CAS Name: (E)-7-[5-[(E)-3-hydroxyoct-1-enyl]-4-oxo-1-cyclopent-2-enyl]-2-heptenoic acid IUPAC Name: (E)-7-[5-[(E)-3-hydroxyoct-1-enyl]-4-oxocyclopent-2-en-1-yl]hept-2-enoic acid Traditional Name: (E)-7-[5-[(E)-3-hydroxyoct-1-enyl]-4-keto-cyclopent-2-en-1-yl]hept-2-enoic acid Formula: C20H30O4 MolecularWeight: 334.4498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1C(C=CC1=O)CCCCC=CC(=O)O)O

Isomeric SMILES

CCCCCC(/C=C/C1C(C=CC1=O)CCCC/C=C/C(=O)O)O

InChI

InChI=1S/C20H30O4/c1-2-3-6-10-17(21)13-14-18-16(12-15-19(18)22)9-7-4-5-8-11-20(23)24/h8,11-18,21H,2-7,9-10H2,1H3,(H,23,24)/b11-8+,14-13+