1-oxidanidyl-7,8,9,10-tetrahydro-6H-cyclohepta[g][1,2,4]benzotriazin-1-ium-3-amine

Systemtic Name: 1-oxidanidyl-7,8,9,10-tetrahydro-6H-cyclohepta[g][1,2,4]benzotriazin-1-ium-3-amine Openeye Name: 1-oxido-7,8,9,10-tetrahydro-6H-cyclohepta[g][1,2,4]benzotriazin-1-ium-3-amine CAS Name: 1-oxido-7,8,9,10-tetrahydro-6H-cyclohepta[g][1,2,4]benzotriazin-1-ium-3-amine IUPAC Name: 1-oxido-7,8,9,10-tetrahydro-6H-cyclohepta[g][1,2,4]benzotriazin-1-ium-3-amine Traditional Name: (1-oxido-7,8,9,10-tetrahydro-6H-cyclohepta[g][1,2,4]benzotriazin-1-ium-3-yl)amine Formula: C12H14N4O MolecularWeight: 230.26576

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=CC3=C(C=C2CC1)[N+](=NC(=N3)N)[O-]

Isomeric SMILES

C1CCC2=CC3=C(C=C2CC1)[N+](=NC(=N3)N)[O-]

InChI

InChI=1S/C12H14N4O/c13-12-14-10-6-8-4-2-1-3-5-9(8)7-11(10)16(17)15-12/h6-7H,1-5H2,(H2,13,14,15)