2-(4-azanyl-1,2,4-triazol-4-ium-1-yl)-1-[2,4-bis(bromanyl)phenyl]ethanone

Systemtic Name: 2-(4-azanyl-1,2,4-triazol-4-ium-1-yl)-1-[2,4-bis(bromanyl)phenyl]ethanone Openeye Name: 2-(4-amino-1,2,4-triazol-4-ium-1-yl)-1-(2,4-dibromophenyl)ethanone CAS Name: 2-(4-amino-1,2,4-triazol-4-ium-1-yl)-1-(2,4-dibromophenyl)ethanone IUPAC Name: 2-(4-amino-1,2,4-triazol-4-ium-1-yl)-1-(2,4-dibromophenyl)ethanone Traditional Name: 2-(4-amino-1,2,4-triazol-4-ium-1-yl)-1-(2,4-dibromophenyl)ethanone Formula: C10H9Br2N4O+ MolecularWeight: 361.01266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)Br)C(=O)CN2C=[N+](C=N2)N

Isomeric SMILES

C1=CC(=C(C=C1Br)Br)C(=O)CN2C=[N+](C=N2)N

InChI

InChI=1S/C10H9Br2N4O/c11-7-1-2-8(9(12)3-7)10(17)4-16-6-15(13)5-14-16/h1-3,5-6H,4,13H2/q+1