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

Systemtic Name: 4-bromanyl-1-[(4-nitrophenyl)methyl]-N-[(E)-(phenylmethylidene)amino]pyrazole-3-carboxamide Openeye Name: N-[(E)-benzylideneamino]-4-bromo-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide CAS Name: 4-bromo-1-[(4-nitrophenyl)methyl]-N-[(E)-(phenylmethylene)amino]-3-pyrazolecarboxamide IUPAC Name: N-[(E)-benzylideneamino]-4-bromo-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Traditional Name: N-[(E)-benzalamino]-4-bromo-1-(4-nitrobenzyl)pyrazole-3-carboxamide Formula: C18H14BrN5O3 MolecularWeight: 428.23946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=NNC(=O)C2=NN(C=C2Br)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)/C=N/NC(=O)C2=NN(C=C2Br)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14BrN5O3/c19-16-12-23(11-14-6-8-15(9-7-14)24(26)27)22-17(16)18(25)21-20-10-13-4-2-1-3-5-13/h1-10,12H,11H2,(H,21,25)/b20-10+