4,5-bis(bromanyl)-N-(4-methyl-3,5-dinitro-phenyl)-1H-pyrazole-3-carboxamide

Systemtic Name: 4,5-bis(bromanyl)-N-(4-methyl-3,5-dinitro-phenyl)-1H-pyrazole-3-carboxamide Openeye Name: 4,5-dibromo-N-(4-methyl-3,5-dinitro-phenyl)-1H-pyrazole-3-carboxamide CAS Name: 4,5-dibromo-N-(4-methyl-3,5-dinitrophenyl)-1H-pyrazole-3-carboxamide IUPAC Name: 4,5-dibromo-N-(4-methyl-3,5-dinitrophenyl)-1H-pyrazole-3-carboxamide Traditional Name: 4,5-dibromo-N-(4-methyl-3,5-dinitro-phenyl)-1H-pyrazole-3-carboxamide Formula: C11H7Br2N5O5 MolecularWeight: 449.01178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=NNC(=C2Br)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=NNC(=C2Br)Br)[N+](=O)[O-]

InChI

InChI=1S/C11H7Br2N5O5/c1-4-6(17(20)21)2-5(3-7(4)18(22)23)14-11(19)9-8(12)10(13)16-15-9/h2-3H,1H3,(H,14,19)(H,15,16)