3-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-[2-(5-methyl-3-nitro-pyrazol-1-yl)ethyl]benzamide

Systemtic Name: 3-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-[2-(5-methyl-3-nitro-pyrazol-1-yl)ethyl]benzamide Openeye Name: 3-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[2-(5-methyl-3-nitro-pyrazol-1-yl)ethyl]benzamide CAS Name: 3-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-[2-(5-methyl-3-nitro-1-pyrazolyl)ethyl]benzamide IUPAC Name: 3-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-[2-(5-methyl-3-nitropyrazol-1-yl)ethyl]benzamide Traditional Name: 3-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[2-(5-methyl-3-nitro-pyrazol-1-yl)ethyl]benzamide Formula: C17H16BrN7O5 MolecularWeight: 478.25684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCNC(=O)C2=CC(=CC=C2)CN3C=C(C(=N3)[N+](=O)[O-])Br)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CCNC(=O)C2=CC(=CC=C2)CN3C=C(C(=N3)[N+](=O)[O-])Br)[N+](=O)[O-]

InChI

InChI=1S/C17H16BrN7O5/c1-11-7-15(24(27)28)20-23(11)6-5-19-17(26)13-4-2-3-12(8-13)9-22-10-14(18)16(21-22)25(29)30/h2-4,7-8,10H,5-6,9H2,1H3,(H,19,26)