3-(4-nitrophenyl)-N-[2-(trifluoromethyl)phenyl]sulfonyl-3,4-dihydropyrazole-2-carboxamide

Systemtic Name: 3-(4-nitrophenyl)-N-[2-(trifluoromethyl)phenyl]sulfonyl-3,4-dihydropyrazole-2-carboxamide Openeye Name: 3-(4-nitrophenyl)-N-[2-(trifluoromethyl)phenyl]sulfonyl-3,4-dihydropyrazole-2-carboxamide CAS Name: 3-(4-nitrophenyl)-N-[2-(trifluoromethyl)phenyl]sulfonyl-3,4-dihydropyrazole-2-carboxamide IUPAC Name: 3-(4-nitrophenyl)-N-[2-(trifluoromethyl)phenyl]sulfonyl-3,4-dihydropyrazole-2-carboxamide Traditional Name: 5-(4-nitrophenyl)-N-[2-(trifluoromethyl)phenyl]sulfonyl-2-pyrazoline-1-carboxamide Formula: C17H13F3N4O5S MolecularWeight: 442.36913

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Descriptors Computed from Structure

Canonical SMILES:

C1C=NN(C1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NS(=O)(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1C=NN(C1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NS(=O)(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C17H13F3N4O5S/c18-17(19,20)13-3-1-2-4-15(13)30(28,29)22-16(25)23-14(9-10-21-23)11-5-7-12(8-6-11)24(26)27/h1-8,10,14H,9H2,(H,22,25)