4-bromanyl-N-(4-cyano-2-phenyl-pyrazol-3-yl)-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: 4-bromanyl-N-(4-cyano-2-phenyl-pyrazol-3-yl)-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: 4-bromo-N-(4-cyano-2-phenyl-pyrazol-3-yl)-3-nitro-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-N-(4-cyano-2-phenyl-3-pyrazolyl)-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: 4-bromo-N-(4-cyano-2-phenylpyrazol-3-yl)-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-N-(4-cyano-2-phenyl-pyrazol-3-yl)-3-nitro-1H-pyrazole-5-carboxamide Formula: C14H8BrN7O3 MolecularWeight: 402.16242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=N2)C#N)NC(=O)C3=C(C(=NN3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=N2)C#N)NC(=O)C3=C(C(=NN3)[N+](=O)[O-])Br

InChI

InChI=1S/C14H8BrN7O3/c15-10-11(19-20-13(10)22(24)25)14(23)18-12-8(6-16)7-17-21(12)9-4-2-1-3-5-9/h1-5,7H,(H,18,23)(H,19,20)