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

Systemtic Name: 2-carboxyethyl-(2-chloroethyl)-(phenylmethyl)azanium chloride Openeye Name: benzyl-(2-carboxyethyl)-(2-chloroethyl)ammonium chloride CAS Name: 2-carboxyethyl-(2-chloroethyl)-(phenylmethyl)ammonium chloride IUPAC Name: benzyl-(2-carboxyethyl)-(2-chloroethyl)azanium chloride Traditional Name: benzyl-(2-carboxyethyl)-(2-chloroethyl)ammonium chloride Formula: C12H17Cl2NO2 MolecularWeight: 278.17488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16ClNO2.ClH/c13-7-9-14(8-6-12(15)16)10-11-4-2-1-3-5-11;/h1-5H,6-10H2,(H,15,16);1H