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

Systemtic Name: N-[(E)-1-(4-bromophenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Openeye Name: N-[(E)-1-(4-bromophenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide CAS Name: N-[(E)-1-(4-bromophenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[(E)-1-(4-bromophenyl)ethylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Traditional Name: N-[(E)-1-(4-bromophenyl)ethylideneamino]-1-(4-nitrobenzyl)pyrazole-3-carboxamide Formula: C19H16BrN5O3 MolecularWeight: 442.26604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NN(C=C1)CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Br

Isomeric SMILES

C/C(=N\NC(=O)C1=NN(C=C1)CC2=CC=C(C=C2)[N+](=O)[O-])/C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H16BrN5O3/c1-13(15-4-6-16(20)7-5-15)21-22-19(26)18-10-11-24(23-18)12-14-2-8-17(9-3-14)25(27)28/h2-11H,12H2,1H3,(H,22,26)/b21-13+