4-[[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]methoxy]benzoic acid

Systemtic Name: 4-[[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]methoxy]benzoic acid Openeye Name: 4-[[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]methoxy]benzoic acid CAS Name: 4-[[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)-3-pyrrolyl]methoxy]benzoic acid IUPAC Name: 4-[[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]methoxy]benzoic acid Traditional Name: 4-[[1-(4-fluorophenyl)-5-(4-mesylphenyl)-2-methyl-pyrrol-3-yl]methoxy]benzoic acid Formula: C26H22FNO5S MolecularWeight: 479.519983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)C)COC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CC1=C(C=C(N1C2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)C)COC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C26H22FNO5S/c1-17-20(16-33-23-11-3-19(4-12-23)26(29)30)15-25(28(17)22-9-7-21(27)8-10-22)18-5-13-24(14-6-18)34(2,31)32/h3-15H,16H2,1-2H3,(H,29,30)