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

Systemtic Name: 2-[2-[3-cyclohexyl-3-oxidanylidene-2-(phenylsulfonyl)propyl]-5-oxidanyl-cyclopent-2-en-1-yl]ethanoic acid Openeye Name: 2-[2-[2-(benzenesulfonyl)-3-cyclohexyl-3-oxo-propyl]-5-hydroxy-cyclopent-2-en-1-yl]acetic acid CAS Name: 2-[2-[2-(benzenesulfonyl)-3-cyclohexyl-3-oxopropyl]-5-hydroxy-1-cyclopent-2-enyl]acetic acid IUPAC Name: 2-[2-[2-(benzenesulfonyl)-3-cyclohexyl-3-oxopropyl]-5-hydroxycyclopent-2-en-1-yl]acetic acid Traditional Name: 2-[2-(2-besyl-3-cyclohexyl-3-keto-propyl)-5-hydroxy-cyclopent-2-en-1-yl]acetic acid Formula: C22H28O6S MolecularWeight: 420.51912

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)C(CC2=CCC(C2CC(=O)O)O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)C(=O)C(CC2=CCC(C2CC(=O)O)O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H28O6S/c23-19-12-11-16(18(19)14-21(24)25)13-20(22(26)15-7-3-1-4-8-15)29(27,28)17-9-5-2-6-10-17/h2,5-6,9-11,15,18-20,23H,1,3-4,7-8,12-14H2,(H,24,25)