5-(3-methoxyphenyl)-N-(3-methylbutyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: 5-(3-methoxyphenyl)-N-(3-methylbutyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-isopentyl-5-(3-methoxyphenyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: 5-(3-methoxyphenyl)-N-(3-methylbutyl)-2-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 5-(3-methoxyphenyl)-N-(3-methylbutyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-isoamyl-5-(3-methoxyphenyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C22H24N4O4 MolecularWeight: 408.45036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O4/c1-15(2)10-11-23-22(27)21-14-20(16-6-4-9-19(12-16)30-3)24-25(21)17-7-5-8-18(13-17)26(28)29/h4-9,12-15H,10-11H2,1-3H3,(H,23,27)