2-[5-oxidanyl-2-[3-oxidanylidene-2-(phenylsulfonyl)octyl]cyclopent-2-en-1-yl]ethanoic acid

Systemtic Name: 2-[5-oxidanyl-2-[3-oxidanylidene-2-(phenylsulfonyl)octyl]cyclopent-2-en-1-yl]ethanoic acid Openeye Name: 2-[2-[2-(benzenesulfonyl)-3-oxo-octyl]-5-hydroxy-cyclopent-2-en-1-yl]acetic acid CAS Name: 2-[2-[2-(benzenesulfonyl)-3-oxooctyl]-5-hydroxy-1-cyclopent-2-enyl]acetic acid IUPAC Name: 2-[2-[2-(benzenesulfonyl)-3-oxooctyl]-5-hydroxycyclopent-2-en-1-yl]acetic acid Traditional Name: 2-[2-(2-besyl-3-keto-octyl)-5-hydroxy-cyclopent-2-en-1-yl]acetic acid Formula: C21H28O6S MolecularWeight: 408.50842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C(CC1=CCC(C1CC(=O)O)O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCC(=O)C(CC1=CCC(C1CC(=O)O)O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H28O6S/c1-2-3-5-10-19(23)20(28(26,27)16-8-6-4-7-9-16)13-15-11-12-18(22)17(15)14-21(24)25/h4,6-9,11,17-18,20,22H,2-3,5,10,12-14H2,1H3,(H,24,25)