2-[4-phenyl-3-(4-sulfamoylphenyl)-5-(trifluoromethyl)pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-phenyl-3-(4-sulfamoylphenyl)-5-(trifluoromethyl)pyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-phenyl-3-(4-sulfamoylphenyl)-5-(trifluoromethyl)pyrazol-1-yl]acetic acid CAS Name: 2-[4-phenyl-3-(4-sulfamoylphenyl)-5-(trifluoromethyl)-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-phenyl-3-(4-sulfamoylphenyl)-5-(trifluoromethyl)pyrazol-1-yl]acetic acid Traditional Name: 2-[4-phenyl-3-(4-sulfamoylphenyl)-5-(trifluoromethyl)pyrazol-1-yl]acetic acid Formula: C18H14F3N3O4S MolecularWeight: 425.38167

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)N)CC(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)N)CC(=O)O)C(F)(F)F

InChI

InChI=1S/C18H14F3N3O4S/c19-18(20,21)17-15(11-4-2-1-3-5-11)16(23-24(17)10-14(25)26)12-6-8-13(9-7-12)29(22,27)28/h1-9H,10H2,(H,25,26)(H2,22,27,28)