1-(benzotriazol-1-ylmethyl)-N,N-dimethyl-pyridin-1-ium-4-amine iodide

Systemtic Name: 1-(benzotriazol-1-ylmethyl)-N,N-dimethyl-pyridin-1-ium-4-amine iodide Openeye Name: 1-(benzotriazol-1-ylmethyl)-N,N-dimethyl-pyridin-1-ium-4-amine iodide CAS Name: 1-(1-benzotriazolylmethyl)-N,N-dimethyl-4-pyridin-1-iumamine iodide IUPAC Name: 1-(benzotriazol-1-ylmethyl)-N,N-dimethylpyridin-1-ium-4-amine iodide Traditional Name: [1-(benzotriazol-1-ylmethyl)pyridin-1-ium-4-yl]-dimethyl-amine iodide Formula: C14H16IN5 MolecularWeight: 381.21481

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)CN2C3=CC=CC=C3N=N2.[I-]

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)CN2C3=CC=CC=C3N=N2.[I-]

InChI

InChI=1S/C14H16N5.HI/c1-17(2)12-7-9-18(10-8-12)11-19-14-6-4-3-5-13(14)15-16-19;/h3-10H,11H2,1-2H3;1H/q+1;/p-1