N-(benzotriazol-1-ylmethyl)-1-(decoxymethyl)pyridin-1-ium-3-amine chloride

Systemtic Name: N-(benzotriazol-1-ylmethyl)-1-(decoxymethyl)pyridin-1-ium-3-amine chloride Openeye Name: N-(benzotriazol-1-ylmethyl)-1-(decoxymethyl)pyridin-1-ium-3-amine chloride CAS Name: N-(1-benzotriazolylmethyl)-1-(decoxymethyl)-3-pyridin-1-iumamine chloride IUPAC Name: N-(benzotriazol-1-ylmethyl)-1-(decoxymethyl)pyridin-1-ium-3-amine chloride Traditional Name: benzotriazol-1-ylmethyl-[1-(decoxymethyl)pyridin-1-ium-3-yl]amine chloride Formula: C23H34ClN5O MolecularWeight: 432.00196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC[N+]1=CC=CC(=C1)NCN2C3=CC=CC=C3N=N2.[Cl-]

Isomeric SMILES

CCCCCCCCCCOC[N+]1=CC=CC(=C1)NCN2C3=CC=CC=C3N=N2.[Cl-]

InChI

InChI=1S/C23H34N5O.ClH/c1-2-3-4-5-6-7-8-11-17-29-20-27-16-12-13-21(18-27)24-19-28-23-15-10-9-14-22(23)25-26-28;/h9-10,12-16,18,24H,2-8,11,17,19-20H2,1H3;1H/q+1;/p-1