3-[(4-bromanylpyrazol-1-yl)methyl]-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide

Systemtic Name: 3-[(4-bromanylpyrazol-1-yl)methyl]-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide Openeye Name: 3-[(4-bromopyrazol-1-yl)methyl]-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide CAS Name: 3-[(4-bromo-1-pyrazolyl)methyl]-N-[2-(4-nitro-1-pyrazolyl)ethyl]benzamide IUPAC Name: 3-[(4-bromopyrazol-1-yl)methyl]-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide Traditional Name: 3-[(4-bromopyrazol-1-yl)methyl]-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide Formula: C16H15BrN6O3 MolecularWeight: 419.2327

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2C=C(C=N2)Br)C(=O)NCCN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)CN2C=C(C=N2)Br)C(=O)NCCN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H15BrN6O3/c17-14-7-19-22(10-14)9-12-2-1-3-13(6-12)16(24)18-4-5-21-11-15(8-20-21)23(25)26/h1-3,6-8,10-11H,4-5,9H2,(H,18,24)