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

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromophenyl)methyl]-N-[(E)-(4-nitrophenyl)methyleneamino]pyrazole-3-carboxamide CAS Name: 1-[(4-bromophenyl)methyl]-N-[(E)-(4-nitrophenyl)methylideneamino]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromophenyl)methyl]-N-[(E)-(4-nitrophenyl)methylideneamino]pyrazole-3-carboxamide Traditional Name: 1-(4-bromobenzyl)-N-[(E)-(4-nitrobenzylidene)amino]pyrazole-3-carboxamide Formula: C18H14BrN5O3 MolecularWeight: 428.23946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=CC(=N2)C(=O)NN=CC3=CC=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1CN2C=CC(=N2)C(=O)N/N=C/C3=CC=C(C=C3)[N+](=O)[O-])Br

InChI

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