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

Systemtic Name: N-butyl-5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-butyl-5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-butyl-5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-butyl-5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-butyl-5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)pyrazole-3-carboxamide Formula: C22H24N4O3 MolecularWeight: 392.45096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O3/c1-4-5-12-23-22(27)21-14-20(17-7-6-15(2)16(3)13-17)24-25(21)18-8-10-19(11-9-18)26(28)29/h6-11,13-14H,4-5,12H2,1-3H3,(H,23,27)