(7E)-7-[4-chloranyl-2-(3,7-dimethyloctyl)-2-oxidanyl-5-oxidanylidene-cyclopent-3-en-1-ylidene]heptanoic acid

Systemtic Name: (7E)-7-[4-chloranyl-2-(3,7-dimethyloctyl)-2-oxidanyl-5-oxidanylidene-cyclopent-3-en-1-ylidene]heptanoic acid Openeye Name: (7E)-7-[4-chloro-2-(3,7-dimethyloctyl)-2-hydroxy-5-oxo-cyclopent-3-en-1-ylidene]heptanoic acid CAS Name: (7E)-7-[4-chloro-2-(3,7-dimethyloctyl)-2-hydroxy-5-oxo-1-cyclopent-3-enylidene]heptanoic acid IUPAC Name: (7E)-7-[4-chloro-2-(3,7-dimethyloctyl)-2-hydroxy-5-oxocyclopent-3-en-1-ylidene]heptanoic acid Traditional Name: (7E)-7-[4-chloro-2-(3,7-dimethyloctyl)-2-hydroxy-5-keto-cyclopent-3-en-1-ylidene]enanthic acid Formula: C22H35ClO4 MolecularWeight: 398.9639

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)CCC1(C=C(C(=O)C1=CCCCCCC(=O)O)Cl)O

Isomeric SMILES

CC(C)CCCC(C)CCC\1(C=C(C(=O)/C1=C/CCCCCC(=O)O)Cl)O

InChI

InChI=1S/C22H35ClO4/c1-16(2)9-8-10-17(3)13-14-22(27)15-19(23)21(26)18(22)11-6-4-5-7-12-20(24)25/h11,15-17,27H,4-10,12-14H2,1-3H3,(H,24,25)/b18-11-