3-[2-[2-[(4-fluorophenyl)methoxy]-5-methylsulfinyl-phenyl]cyclopenten-1-yl]benzoic acid

Systemtic Name: 3-[2-[2-[(4-fluorophenyl)methoxy]-5-methylsulfinyl-phenyl]cyclopenten-1-yl]benzoic acid Openeye Name: 3-[2-[2-[(4-fluorophenyl)methoxy]-5-methylsulfinyl-phenyl]cyclopenten-1-yl]benzoic acid CAS Name: 3-[2-[2-[(4-fluorophenyl)methoxy]-5-methylsulfinylphenyl]-1-cyclopentenyl]benzoic acid IUPAC Name: 3-[2-[2-[(4-fluorophenyl)methoxy]-5-methylsulfinylphenyl]cyclopenten-1-yl]benzoic acid Traditional Name: 3-[2-[2-(4-fluorobenzyl)oxy-5-methylsulfinyl-phenyl]cyclopenten-1-yl]benzoic acid Formula: C26H23FO4S MolecularWeight: 450.521823

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=CC(=C(C=C1)OCC2=CC=C(C=C2)F)C3=C(CCC3)C4=CC(=CC=C4)C(=O)O

Isomeric SMILES

CS(=O)C1=CC(=C(C=C1)OCC2=CC=C(C=C2)F)C3=C(CCC3)C4=CC(=CC=C4)C(=O)O

InChI

InChI=1S/C26H23FO4S/c1-32(30)21-12-13-25(31-16-17-8-10-20(27)11-9-17)24(15-21)23-7-3-6-22(23)18-4-2-5-19(14-18)26(28)29/h2,4-5,8-15H,3,6-7,16H2,1H3,(H,28,29)