4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1H-pyrrole-2-sulfonic acid

Systemtic Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1H-pyrrole-2-sulfonic acid Openeye Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1H-pyrrole-2-sulfonic acid CAS Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1H-pyrrole-2-sulfonic acid IUPAC Name: 4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1H-pyrrole-2-sulfonic acid Traditional Name: 4-(4-fluorophenyl)-5-(4-mesylphenyl)-1H-pyrrole-2-sulfonic acid Formula: C17H14FNO5S2 MolecularWeight: 395.425163

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C=C(N2)S(=O)(=O)O)C3=CC=C(C=C3)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C=C(N2)S(=O)(=O)O)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H14FNO5S2/c1-25(20,21)14-8-4-12(5-9-14)17-15(10-16(19-17)26(22,23)24)11-2-6-13(18)7-3-11/h2-10,19H,1H3,(H,22,23,24)