3-[(3-methylimidazol-3-ium-1-yl)methyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[(3-methylimidazol-3-ium-1-yl)methyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(3-methylimidazol-3-ium-1-yl)methyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[(3-methyl-1-imidazol-3-iumyl)methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(3-methylimidazol-3-ium-1-yl)methyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[(3-methylimidazol-3-ium-1-yl)methyl]-1,2,3-benzotriazin-4-one Formula: C12H12N5O+ MolecularWeight: 242.25658

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)CN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

C[N+]1=CN(C=C1)CN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C12H12N5O/c1-15-6-7-16(8-15)9-17-12(18)10-4-2-3-5-11(10)13-14-17/h2-8H,9H2,1H3/q+1