2-[4-[2-(3-oxidanylhexyl)-5-oxidanylidene-cyclopentyl]butylsulfanyl]ethanoic acid

Systemtic Name: 2-[4-[2-(3-oxidanylhexyl)-5-oxidanylidene-cyclopentyl]butylsulfanyl]ethanoic acid Openeye Name: 2-[4-[2-(3-hydroxyhexyl)-5-oxo-cyclopentyl]butylsulfanyl]acetic acid CAS Name: 2-[4-[2-(3-hydroxyhexyl)-5-oxocyclopentyl]butylthio]acetic acid IUPAC Name: 2-[4-[2-(3-hydroxyhexyl)-5-oxocyclopentyl]butylsulfanyl]acetic acid Traditional Name: 2-[4-[2-(3-hydroxyhexyl)-5-keto-cyclopentyl]butylthio]acetic acid Formula: C17H30O4S MolecularWeight: 330.4827

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC1CCC(=O)C1CCCCSCC(=O)O)O

Isomeric SMILES

CCCC(CCC1CCC(=O)C1CCCCSCC(=O)O)O

InChI

InChI=1S/C17H30O4S/c1-2-5-14(18)9-7-13-8-10-16(19)15(13)6-3-4-11-22-12-17(20)21/h13-15,18H,2-12H2,1H3,(H,20,21)