2-(benzotriazol-1-yl)ethyl-(2-chloroethyl)-ethyl-azanium chloride

Systemtic Name: 2-(benzotriazol-1-yl)ethyl-(2-chloroethyl)-ethyl-azanium chloride Openeye Name: 2-(benzotriazol-1-yl)ethyl-(2-chloroethyl)-ethyl-ammonium chloride CAS Name: 2-(1-benzotriazolyl)ethyl-(2-chloroethyl)-ethylammonium chloride IUPAC Name: 2-(benzotriazol-1-yl)ethyl-(2-chloroethyl)-ethylazanium chloride Traditional Name: 2-(benzotriazol-1-yl)ethyl-(2-chloroethyl)-ethyl-ammonium chloride Formula: C12H18Cl2N4 MolecularWeight: 289.20412

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCN1C2=CC=CC=C2N=N1)CCCl.[Cl-]

Isomeric SMILES

CC[NH+](CCN1C2=CC=CC=C2N=N1)CCCl.[Cl-]

InChI

InChI=1S/C12H17ClN4.ClH/c1-2-16(8-7-13)9-10-17-12-6-4-3-5-11(12)14-15-17;/h3-6H,2,7-10H2,1H3;1H