bis(1H-imidazol-2-yl)methanone; carbononitridic bromide; pentanedial

Systemtic Name: bis(1H-imidazol-2-yl)methanone; carbononitridic bromide; pentanedial Openeye Name: bis(1H-imidazol-2-yl)methanone; carbononitridic bromide; pentanedial CAS Name: bis(1H-imidazol-2-yl)methanone; carbononitridic bromide; pentanedial IUPAC Name: bis(1H-imidazol-2-yl)methanone; carbononitridic bromide; pentanedial Traditional Name: bis(1H-imidazol-2-yl)methanone; cyanogen bromide; glutaraldehyde Formula: C13H14BrN5O3 MolecularWeight: 368.18596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N1)C(=O)C2=NC=CN2.C(CC=O)CC=O.C(#N)Br

Isomeric SMILES

C1=CN=C(N1)C(=O)C2=NC=CN2.C(CC=O)CC=O.C(#N)Br

InChI

InChI=1S/C7H6N4O.C5H8O2.CBrN/c12-5(6-8-1-2-9-6)7-10-3-4-11-7;6-4-2-1-3-5-7;2-1-3/h1-4H,(H,8,9)(H,10,11);4-5H,1-3H2;