4-[2,4-bis(4-nitrophenyl)-5-(trifluoromethyl)pyrazol-3-yl]benzenesulfonamide

Systemtic Name: 4-[2,4-bis(4-nitrophenyl)-5-(trifluoromethyl)pyrazol-3-yl]benzenesulfonamide Openeye Name: 4-[2,4-bis(4-nitrophenyl)-5-(trifluoromethyl)pyrazol-3-yl]benzenesulfonamide CAS Name: 4-[2,4-bis(4-nitrophenyl)-5-(trifluoromethyl)-3-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[2,4-bis(4-nitrophenyl)-5-(trifluoromethyl)pyrazol-3-yl]benzenesulfonamide Traditional Name: 4-[2,4-bis(4-nitrophenyl)-5-(trifluoromethyl)pyrazol-3-yl]benzenesulfonamide Formula: C22H14F3N5O6S MolecularWeight: 533.43667

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(N(N=C2C(F)(F)F)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=C(N(N=C2C(F)(F)F)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C22H14F3N5O6S/c23-22(24,25)21-19(13-1-5-16(6-2-13)29(31)32)20(14-3-11-18(12-4-14)37(26,35)36)28(27-21)15-7-9-17(10-8-15)30(33)34/h1-12H,(H2,26,35,36)