2-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)-N-(2-methoxy-4-nitro-phenyl)ethanamide

Systemtic Name: 2-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)-N-(2-methoxy-4-nitro-phenyl)ethanamide Openeye Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-methoxy-4-nitro-phenyl)acetamide CAS Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-methoxy-4-nitrophenyl)acetamide IUPAC Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-methoxy-4-nitrophenyl)acetamide Traditional Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(2-methoxy-4-nitro-phenyl)acetamide Formula: C11H9BrN6O6 MolecularWeight: 401.12976

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CN2C(=NC(=N2)[N+](=O)[O-])Br

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CN2C(=NC(=N2)[N+](=O)[O-])Br

InChI

InChI=1S/C11H9BrN6O6/c1-24-8-4-6(17(20)21)2-3-7(8)13-9(19)5-16-10(12)14-11(15-16)18(22)23/h2-4H,5H2,1H3,(H,13,19)