7-[(1S,2S)-2-heptylsulfanyl-5-oxidanylidene-cyclopentyl]-2,2-bis(oxidanyl)heptanoic acid

Systemtic Name: 7-[(1S,2S)-2-heptylsulfanyl-5-oxidanylidene-cyclopentyl]-2,2-bis(oxidanyl)heptanoic acid Openeye Name: 7-[(1S,2S)-2-heptylsulfanyl-5-oxo-cyclopentyl]-2,2-dihydroxy-heptanoic acid CAS Name: 7-[(1S,2S)-2-(heptylthio)-5-oxocyclopentyl]-2,2-dihydroxyheptanoic acid IUPAC Name: 7-[(1S,2S)-2-heptylsulfanyl-5-oxocyclopentyl]-2,2-dihydroxyheptanoic acid Traditional Name: 7-[(1S,2S)-2-(heptylthio)-5-keto-cyclopentyl]-2,2-dihydroxy-enanthic acid Formula: C19H34O5S MolecularWeight: 374.53526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1CCC(=O)C1CCCCCC(C(=O)O)(O)O

Isomeric SMILES

CCCCCCCS[C@H]1CCC(=O)[C@@H]1CCCCCC(C(=O)O)(O)O

InChI

InChI=1S/C19H34O5S/c1-2-3-4-5-9-14-25-17-12-11-16(20)15(17)10-7-6-8-13-19(23,24)18(21)22/h15,17,23-24H,2-14H2,1H3,(H,21,22)/t15-,17-/m0/s1