N',N'-dimethyl-N-(1-oxidanidyl-1,2,4-benzotriazin-1-ium-3-yl)propane-1,3-diamine

Systemtic Name: N',N'-dimethyl-N-(1-oxidanidyl-1,2,4-benzotriazin-1-ium-3-yl)propane-1,3-diamine Openeye Name: N',N'-dimethyl-N-(1-oxido-1,2,4-benzotriazin-1-ium-3-yl)propane-1,3-diamine CAS Name: N',N'-dimethyl-N-(1-oxido-1,2,4-benzotriazin-1-ium-3-yl)propane-1,3-diamine IUPAC Name: N',N'-dimethyl-N-(1-oxido-1,2,4-benzotriazin-1-ium-3-yl)propane-1,3-diamine Traditional Name: dimethyl-[3-[(1-oxido-1,2,4-benzotriazin-1-ium-3-yl)amino]propyl]amine Formula: C12H17N5O MolecularWeight: 247.29628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N5O/c1-16(2)9-5-8-13-12-14-10-6-3-4-7-11(10)17(18)15-12/h3-4,6-7H,5,8-9H2,1-2H3,(H,13,14,15)