1-oxidanidyl-N-propyl-1,2,4-benzotriazin-1-ium-3-amine

Systemtic Name: 1-oxidanidyl-N-propyl-1,2,4-benzotriazin-1-ium-3-amine Openeye Name: 1-oxido-N-propyl-1,2,4-benzotriazin-1-ium-3-amine CAS Name: 1-oxido-N-propyl-1,2,4-benzotriazin-1-ium-3-amine IUPAC Name: 1-oxido-N-propyl-1,2,4-benzotriazin-1-ium-3-amine Traditional Name: (1-oxido-1,2,4-benzotriazin-1-ium-3-yl)-propyl-amine Formula: C10H12N4O MolecularWeight: 204.22848

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC2=CC=CC=C2[N+](=N1)[O-]

Isomeric SMILES

CCCNC1=NC2=CC=CC=C2[N+](=N1)[O-]

InChI

InChI=1S/C10H12N4O/c1-2-7-11-10-12-8-5-3-4-6-9(8)14(15)13-10/h3-6H,2,7H2,1H3,(H,11,12,13)