2-chloroethyl-(phenylmethyl)-propyl-azanium chloride

Systemtic Name: 2-chloroethyl-(phenylmethyl)-propyl-azanium chloride Openeye Name: benzyl-(2-chloroethyl)-propyl-ammonium chloride CAS Name: 2-chloroethyl-(phenylmethyl)-propylammonium chloride IUPAC Name: benzyl-(2-chloroethyl)-propylazanium chloride Traditional Name: benzyl-(2-chloroethyl)-propyl-ammonium chloride Formula: C12H19Cl2N MolecularWeight: 248.19196

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCCl)CC1=CC=CC=C1.[Cl-]

Isomeric SMILES

CCC[NH+](CCCl)CC1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C12H18ClN.ClH/c1-2-9-14(10-8-13)11-12-6-4-3-5-7-12;/h3-7H,2,8-11H2,1H3;1H