4-bromanyl-N-(4-ethylphenyl)-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: 4-bromanyl-N-(4-ethylphenyl)-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: 4-bromo-N-(4-ethylphenyl)-3-nitro-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-N-(4-ethylphenyl)-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: 4-bromo-N-(4-ethylphenyl)-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-N-(4-ethylphenyl)-3-nitro-1H-pyrazole-5-carboxamide Formula: C12H11BrN4O3 MolecularWeight: 339.14474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(C(=NN2)[N+](=O)[O-])Br

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(C(=NN2)[N+](=O)[O-])Br

InChI

InChI=1S/C12H11BrN4O3/c1-2-7-3-5-8(6-4-7)14-12(18)10-9(13)11(16-15-10)17(19)20/h3-6H,2H2,1H3,(H,14,18)(H,15,16)