5-(4-nitrophenyl)-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 5-(4-nitrophenyl)-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide Openeye Name: 5-(4-nitrophenyl)-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide CAS Name: 5-(4-nitrophenyl)-2-(1-pyrazolyl)-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: 5-(4-nitrophenyl)-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide Traditional Name: 5-(4-nitrophenyl)-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide Formula: C16H11F3N4O4S MolecularWeight: 412.34315

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=C(C=C(C=C2S(=O)(=O)N)C3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CN(N=C1)C2=C(C=C(C=C2S(=O)(=O)N)C3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C16H11F3N4O4S/c17-16(18,19)13-8-11(10-2-4-12(5-3-10)23(24)25)9-14(28(20,26)27)15(13)22-7-1-6-21-22/h1-9H,(H2,20,26,27)