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

Systemtic Name: 7-methyl-1-oxidanidyl-N-propyl-1,2,4-benzotriazin-1-ium-3-amine Openeye Name: 7-methyl-1-oxido-N-propyl-1,2,4-benzotriazin-1-ium-3-amine CAS Name: 7-methyl-1-oxido-N-propyl-1,2,4-benzotriazin-1-ium-3-amine IUPAC Name: 7-methyl-1-oxido-N-propyl-1,2,4-benzotriazin-1-ium-3-amine Traditional Name: (7-methyl-1-oxido-1,2,4-benzotriazin-1-ium-3-yl)-propyl-amine Formula: C11H14N4O MolecularWeight: 218.25506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N4O/c1-3-6-12-11-13-9-5-4-8(2)7-10(9)15(16)14-11/h4-5,7H,3,6H2,1-2H3,(H,12,13,14)