5-(4-chlorophenyl)-4-(2-methyl-2-nitro-propyl)-N-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazole-2-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-4-(2-methyl-2-nitro-propyl)-N-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazole-2-carboxamide Openeye Name: 5-(4-chlorophenyl)-4-(2-methyl-2-nitro-propyl)-N-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazole-2-carboxamide CAS Name: 5-(4-chlorophenyl)-4-(2-methyl-2-nitropropyl)-N-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazole-2-carboxamide IUPAC Name: 5-(4-chlorophenyl)-4-(2-methyl-2-nitropropyl)-N-[3-(trifluoromethyl)phenyl]-3,4-dihydropyrazole-2-carboxamide Traditional Name: 3-(4-chlorophenyl)-4-(2-methyl-2-nitro-propyl)-N-[3-(trifluoromethyl)phenyl]-2-pyrazoline-1-carboxamide Formula: C21H20ClF3N4O3 MolecularWeight: 468.85671

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(CC1CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C21H20ClF3N4O3/c1-20(2,29(31)32)11-14-12-28(27-18(14)13-6-8-16(22)9-7-13)19(30)26-17-5-3-4-15(10-17)21(23,24)25/h3-10,14H,11-12H2,1-2H3,(H,26,30)