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

Systemtic Name: (E)-7-[2-[(E)-7-chloranyl-4-methyl-4-oxidanyl-hept-1-enyl]-3-oxidanyl-5-oxidanylidene-cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[2-[(E)-7-chloro-4-hydroxy-4-methyl-hept-1-enyl]-3-hydroxy-5-oxo-cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[2-[(E)-7-chloro-4-hydroxy-4-methylhept-1-enyl]-3-hydroxy-5-oxocyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[2-[(E)-7-chloro-4-hydroxy-4-methylhept-1-enyl]-3-hydroxy-5-oxocyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[2-[(E)-7-chloro-4-hydroxy-4-methyl-hept-1-enyl]-3-hydroxy-5-keto-cyclopentyl]hept-5-enoic acid Formula: C20H31ClO5 MolecularWeight: 386.91014

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCl)(CC=CC1C(CC(=O)C1CC=CCCCC(=O)O)O)O

Isomeric SMILES

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

InChI

InChI=1S/C20H31ClO5/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/h2,4,6,9,15-16,18,23,26H,3,5,7-8,10-14H2,1H3,(H,24,25)/b4-2+,9-6+