N-(3-bromophenyl)-1-[(4-nitropyrazol-1-yl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(3-bromophenyl)-1-[(4-nitropyrazol-1-yl)methyl]pyrazole-3-carboxamide Openeye Name: N-(3-bromophenyl)-1-[(4-nitropyrazol-1-yl)methyl]pyrazole-3-carboxamide CAS Name: N-(3-bromophenyl)-1-[(4-nitro-1-pyrazolyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(3-bromophenyl)-1-[(4-nitropyrazol-1-yl)methyl]pyrazole-3-carboxamide Traditional Name: N-(3-bromophenyl)-1-[(4-nitropyrazol-1-yl)methyl]pyrazole-3-carboxamide Formula: C14H11BrN6O3 MolecularWeight: 391.17954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC(=O)C2=NN(C=C2)CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC(=O)C2=NN(C=C2)CN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C14H11BrN6O3/c15-10-2-1-3-11(6-10)17-14(22)13-4-5-19(18-13)9-20-8-12(7-16-20)21(23)24/h1-8H,9H2,(H,17,22)