3-bromanyl-12H-benzotriazolo[2,1-a]benzotriazol-11-ium

Systemtic Name: 3-bromanyl-12H-benzotriazolo[2,1-a]benzotriazol-11-ium Openeye Name: 3-bromo-12H-benzotriazolo[2,1-a]benzotriazol-11-ium CAS Name: 3-bromo-12H-benzotriazolo[2,1-a]benzotriazol-11-ium IUPAC Name: 3-bromo-12H-benzotriazolo[2,1-a]benzotriazol-11-ium Traditional Name: 3-bromo-12H-benzotriazolo[2,1-a]benzotriazol-11-ium Formula: C12H8BrN4+ MolecularWeight: 288.12272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NN3C4=C(C=CC(=C4)Br)N[N+]3=C2C=C1

Isomeric SMILES

C1=CC2=NN3C4=C(C=CC(=C4)Br)N[N+]3=C2C=C1

InChI

InChI=1S/C12H8BrN4/c13-8-5-6-10-12(7-8)17-14-9-3-1-2-4-11(9)16(17)15-10/h1-7,15H/q+1