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

Systemtic Name: 1-[(3-bromophenyl)methyl]-4-nitro-N-[(E)-(3-phenoxyphenyl)methylideneamino]pyrazole-3-carboxamide Openeye Name: 1-[(3-bromophenyl)methyl]-4-nitro-N-[(E)-(3-phenoxyphenyl)methyleneamino]pyrazole-3-carboxamide CAS Name: 1-[(3-bromophenyl)methyl]-4-nitro-N-[(E)-(3-phenoxyphenyl)methylideneamino]-3-pyrazolecarboxamide IUPAC Name: 1-[(3-bromophenyl)methyl]-4-nitro-N-[(E)-(3-phenoxyphenyl)methylideneamino]pyrazole-3-carboxamide Traditional Name: 1-(3-bromobenzyl)-4-nitro-N-[(E)-(3-phenoxybenzylidene)amino]pyrazole-3-carboxamide Formula: C24H18BrN5O4 MolecularWeight: 520.33482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)C=NNC(=O)C3=NN(C=C3[N+](=O)[O-])CC4=CC(=CC=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)/C=N/NC(=O)C3=NN(C=C3[N+](=O)[O-])CC4=CC(=CC=C4)Br

InChI

InChI=1S/C24H18BrN5O4/c25-19-8-4-7-18(12-19)15-29-16-22(30(32)33)23(28-29)24(31)27-26-14-17-6-5-11-21(13-17)34-20-9-2-1-3-10-20/h1-14,16H,15H2,(H,27,31)/b26-14+