cyclopent-2-en-1-one; (E)-7-[(1S,2S)-2-octylcyclopentyl]hept-2-enoic acid

Systemtic Name: cyclopent-2-en-1-one; (E)-7-[(1S,2S)-2-octylcyclopentyl]hept-2-enoic acid Openeye Name: cyclopent-2-en-1-one; (E)-7-[(1S,2S)-2-octylcyclopentyl]hept-2-enoic acid CAS Name: 1-cyclopent-2-enone; (E)-7-[(1S,2S)-2-octylcyclopentyl]-2-heptenoic acid IUPAC Name: cyclopent-2-en-1-one; (E)-7-[(1S,2S)-2-octylcyclopentyl]hept-2-enoic acid Traditional Name: cyclopent-2-en-1-one; (E)-7-[(1S,2S)-2-octylcyclopentyl]hept-2-enoic acid Formula: C25H42O3 MolecularWeight: 390.59918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCCC1CCCCC=CC(=O)O.C1CC(=O)C=C1

Isomeric SMILES

CCCCCCCC[C@H]1CCC[C@@H]1CCCC/C=C/C(=O)O.C1CC(=O)C=C1

InChI

InChI=1S/C20H36O2.C5H6O/c1-2-3-4-5-6-9-13-18-15-12-16-19(18)14-10-7-8-11-17-20(21)22;6-5-3-1-2-4-5/h11,17-19H,2-10,12-16H2,1H3,(H,21,22);1,3H,2,4H2/b17-11+;/t18-,19-;/m0./s1