(7E)-7-[3-chloranyl-5-(3,7-dimethyloct-6-enyl)-2-oxidanylidene-cyclopent-3-en-1-ylidene]heptanoic acid

Systemtic Name: (7E)-7-[3-chloranyl-5-(3,7-dimethyloct-6-enyl)-2-oxidanylidene-cyclopent-3-en-1-ylidene]heptanoic acid Openeye Name: (7E)-7-[3-chloro-5-(3,7-dimethyloct-6-enyl)-2-oxo-cyclopent-3-en-1-ylidene]heptanoic acid CAS Name: (7E)-7-[3-chloro-5-(3,7-dimethyloct-6-enyl)-2-oxo-1-cyclopent-3-enylidene]heptanoic acid IUPAC Name: (7E)-7-[3-chloro-5-(3,7-dimethyloct-6-enyl)-2-oxocyclopent-3-en-1-ylidene]heptanoic acid Traditional Name: (7E)-7-[3-chloro-5-(3,7-dimethyloct-6-enyl)-2-keto-cyclopent-3-en-1-ylidene]enanthic acid Formula: C22H33ClO3 MolecularWeight: 380.94862

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=C(C)C)CCC1C=C(C(=O)C1=CCCCCCC(=O)O)Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H33ClO3/c1-16(2)9-8-10-17(3)13-14-18-15-20(23)22(26)19(18)11-6-4-5-7-12-21(24)25/h9,11,15,17-18H,4-8,10,12-14H2,1-3H3,(H,24,25)/b19-11+