4-bromanyl-N-butan-2-yl-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: 4-bromanyl-N-butan-2-yl-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: 4-bromo-3-nitro-N-sec-butyl-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-N-butan-2-yl-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: 4-bromo-N-butan-2-yl-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-3-nitro-N-sec-butyl-1H-pyrazole-5-carboxamide Formula: C8H11BrN4O3 MolecularWeight: 291.10194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C(=NN1)[N+](=O)[O-])Br

Isomeric SMILES

CCC(C)NC(=O)C1=C(C(=NN1)[N+](=O)[O-])Br

InChI

InChI=1S/C8H11BrN4O3/c1-3-4(2)10-8(14)6-5(9)7(12-11-6)13(15)16/h4H,3H2,1-2H3,(H,10,14)(H,11,12)