4-bromanyl-N-(2-chloranyl-4-nitro-phenyl)-2,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-(2-chloranyl-4-nitro-phenyl)-2,5-dimethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-(2-chloro-4-nitro-phenyl)-2,5-dimethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-(2-chloro-4-nitrophenyl)-2,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-(2-chloro-4-nitrophenyl)-2,5-dimethylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-(2-chloro-4-nitro-phenyl)-2,5-dimethyl-pyrazole-3-carboxamide Formula: C12H10BrClN4O3 MolecularWeight: 373.5898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1Br)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=NN(C(=C1Br)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C12H10BrClN4O3/c1-6-10(13)11(17(2)16-6)12(19)15-9-4-3-7(18(20)21)5-8(9)14/h3-5H,1-2H3,(H,15,19)