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

Systemtic Name: (7E)-7-[(2S)-2-[(E)-oct-1-enyl]-5-oxidanylidene-cyclopent-3-en-1-ylidene]heptanoic acid Openeye Name: (7E)-7-[(2S)-2-[(E)-oct-1-enyl]-5-oxo-cyclopent-3-en-1-ylidene]heptanoic acid CAS Name: (7E)-7-[(2S)-2-[(E)-oct-1-enyl]-5-oxo-1-cyclopent-3-enylidene]heptanoic acid IUPAC Name: (7E)-7-[(2S)-2-[(E)-oct-1-enyl]-5-oxocyclopent-3-en-1-ylidene]heptanoic acid Traditional Name: (7E)-7-[(5S)-2-keto-5-[(E)-oct-1-enyl]cyclopent-3-en-1-ylidene]enanthic acid Formula: C20H30O3 MolecularWeight: 318.4504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1C=CC(=O)C1=CCCCCCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C20H30O3/c1-2-3-4-5-6-9-12-17-15-16-19(21)18(17)13-10-7-8-11-14-20(22)23/h9,12-13,15-17H,2-8,10-11,14H2,1H3,(H,22,23)/b12-9+,18-13+/t17-/m0/s1