N-[2,6-bis(bromanyl)-4-nitro-phenyl]-2-(4-bromanylpyrazol-1-yl)propanamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-nitro-phenyl]-2-(4-bromanylpyrazol-1-yl)propanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-(2,6-dibromo-4-nitro-phenyl)propanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-(2,6-dibromo-4-nitrophenyl)propanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-(2,6-dibromo-4-nitrophenyl)propanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-(2,6-dibromo-4-nitro-phenyl)propionamide Formula: C12H9Br3N4O3 MolecularWeight: 496.93686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1Br)[N+](=O)[O-])Br)N2C=C(C=N2)Br

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1Br)[N+](=O)[O-])Br)N2C=C(C=N2)Br

InChI

InChI=1S/C12H9Br3N4O3/c1-6(18-5-7(13)4-16-18)12(20)17-11-9(14)2-8(19(21)22)3-10(11)15/h2-6H,1H3,(H,17,20)