N-butyl-2-(4-chlorophenyl)-5-(4-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-butyl-2-(4-chlorophenyl)-5-(4-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-butyl-2-(4-chlorophenyl)-5-(4-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-butyl-2-(4-chlorophenyl)-5-(4-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-butyl-2-(4-chlorophenyl)-5-(4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-butyl-2-(4-chlorophenyl)-5-(4-nitrophenyl)pyrazole-3-carboxamide Formula: C20H19ClN4O3 MolecularWeight: 398.84286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=NN1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=O)C1=CC(=NN1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19ClN4O3/c1-2-3-12-22-20(26)19-13-18(14-4-8-17(9-5-14)25(27)28)23-24(19)16-10-6-15(21)7-11-16/h4-11,13H,2-3,12H2,1H3,(H,22,26)