1-(4-bromophenyl)-2-(3-nitro-1,2,4-triazol-1-yl)ethanone

Systemtic Name: 1-(4-bromophenyl)-2-(3-nitro-1,2,4-triazol-1-yl)ethanone Openeye Name: 1-(4-bromophenyl)-2-(3-nitro-1,2,4-triazol-1-yl)ethanone CAS Name: 1-(4-bromophenyl)-2-(3-nitro-1,2,4-triazol-1-yl)ethanone IUPAC Name: 1-(4-bromophenyl)-2-(3-nitro-1,2,4-triazol-1-yl)ethanone Traditional Name: 1-(4-bromophenyl)-2-(3-nitro-1,2,4-triazol-1-yl)ethanone Formula: C10H7BrN4O3 MolecularWeight: 311.09158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CN2C=NC(=N2)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)CN2C=NC(=N2)[N+](=O)[O-])Br

InChI

InChI=1S/C10H7BrN4O3/c11-8-3-1-7(2-4-8)9(16)5-14-6-12-10(13-14)15(17)18/h1-4,6H,5H2