4-bromanyl-1-methyl-N-[(E)-1-(4-nitrophenyl)ethylideneamino]pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-1-methyl-N-[(E)-1-(4-nitrophenyl)ethylideneamino]pyrazole-3-carboxamide Openeye Name: 4-bromo-1-methyl-N-[(E)-1-(4-nitrophenyl)ethylideneamino]pyrazole-3-carboxamide CAS Name: 4-bromo-1-methyl-N-[(E)-1-(4-nitrophenyl)ethylideneamino]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-1-methyl-N-[(E)-1-(4-nitrophenyl)ethylideneamino]pyrazole-3-carboxamide Traditional Name: 4-bromo-1-methyl-N-[(E)-1-(4-nitrophenyl)ethylideneamino]pyrazole-3-carboxamide Formula: C13H12BrN5O3 MolecularWeight: 366.17008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NN(C=C1Br)C)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC(=O)C1=NN(C=C1Br)C)/C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H12BrN5O3/c1-8(9-3-5-10(6-4-9)19(21)22)15-16-13(20)12-11(14)7-18(2)17-12/h3-7H,1-2H3,(H,16,20)/b15-8+