(7E)-7-[(2S)-2-octyl-5-oxidanylidene-cyclopent-3-en-1-ylidene]heptanoic acid

Systemtic Name: (7E)-7-[(2S)-2-octyl-5-oxidanylidene-cyclopent-3-en-1-ylidene]heptanoic acid Openeye Name: (7E)-7-[(2S)-2-octyl-5-oxo-cyclopent-3-en-1-ylidene]heptanoic acid CAS Name: (7E)-7-[(2S)-2-octyl-5-oxo-1-cyclopent-3-enylidene]heptanoic acid IUPAC Name: (7E)-7-[(2S)-2-octyl-5-oxocyclopent-3-en-1-ylidene]heptanoic acid Traditional Name: (7E)-7-[(5S)-2-keto-5-octyl-cyclopent-3-en-1-ylidene]enanthic acid Formula: C20H32O3 MolecularWeight: 320.46628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1C=CC(=O)C1=CCCCCCC(=O)O

Isomeric SMILES

CCCCCCCC[C@H]\1C=CC(=O)/C1=C/CCCCCC(=O)O

InChI

InChI=1S/C20H32O3/c1-2-3-4-5-6-9-12-17-15-16-19(21)18(17)13-10-7-8-11-14-20(22)23/h13,15-17H,2-12,14H2,1H3,(H,22,23)/b18-13+/t17-/m0/s1