N,N-dimethyl-3-(1-oxidanidyl-4-oxidanylidene-1,2,4-benzotriazin-4-ium-3-yl)propan-1-amine chloride

Systemtic Name: N,N-dimethyl-3-(1-oxidanidyl-4-oxidanylidene-1,2,4-benzotriazin-4-ium-3-yl)propan-1-amine chloride Openeye Name: N,N-dimethyl-3-(1-oxido-4-oxo-1,2,4-benzotriazin-4-ium-3-yl)propan-1-amine chloride CAS Name: N,N-dimethyl-3-(1-oxido-4-oxo-1,2,4-benzotriazin-4-ium-3-yl)-1-propanamine chloride IUPAC Name: N,N-dimethyl-3-(1-oxido-4-oxo-1,2,4-benzotriazin-4-ium-3-yl)propan-1-amine chloride Traditional Name: 3-(4-keto-1-oxido-1,2,4-benzotriazin-4-ium-3-yl)propyl-dimethyl-amine chloride Formula: C12H16ClN4O2- MolecularWeight: 283.73404

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCC1=NN(C2=CC=CC=C2[N+]1=O)[O-].[Cl-]

Isomeric SMILES

CN(C)CCCC1=NN(C2=CC=CC=C2[N+]1=O)[O-].[Cl-]

InChI

InChI=1S/C12H16N4O2.ClH/c1-14(2)9-5-8-12-13-16(18)11-7-4-3-6-10(11)15(12)17;/h3-4,6-7H,5,8-9H2,1-2H3;1H/p-1