7-[2-[(E)-7-chloranyl-4-methyl-4-oxidanyl-hept-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoic acid

Systemtic Name: 7-[2-[(E)-7-chloranyl-4-methyl-4-oxidanyl-hept-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]heptanoic acid Openeye Name: 7-[2-[(E)-7-chloro-4-hydroxy-4-methyl-hept-1-enyl]-3-hydroxy-5-oxo-cyclopentyl]heptanoic acid CAS Name: 7-[2-[(E)-7-chloro-4-hydroxy-4-methylhept-1-enyl]-3-hydroxy-5-oxocyclopentyl]heptanoic acid IUPAC Name: 7-[2-[(E)-7-chloro-4-hydroxy-4-methylhept-1-enyl]-3-hydroxy-5-oxocyclopentyl]heptanoic acid Traditional Name: 7-[2-[(E)-7-chloro-4-hydroxy-4-methyl-hept-1-enyl]-3-hydroxy-5-keto-cyclopentyl]enanthic acid Formula: C20H33ClO5 MolecularWeight: 388.92602

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCl)(CC=CC1C(CC(=O)C1CCCCCCC(=O)O)O)O

Isomeric SMILES

CC(CCCCl)(C/C=C/C1C(CC(=O)C1CCCCCCC(=O)O)O)O

InChI

InChI=1S/C20H33ClO5/c1-20(26,12-7-13-21)11-6-9-16-15(17(22)14-18(16)23)8-4-2-3-5-10-19(24)25/h6,9,15-16,18,23,26H,2-5,7-8,10-14H2,1H3,(H,24,25)/b9-6+