2-chloroethyl-(phenylmethyl)-prop-2-enyl-azanium chloride

Systemtic Name: 2-chloroethyl-(phenylmethyl)-prop-2-enyl-azanium chloride Openeye Name: allyl-benzyl-(2-chloroethyl)ammonium chloride CAS Name: 2-chloroethyl-(phenylmethyl)-prop-2-enylammonium chloride IUPAC Name: benzyl-(2-chloroethyl)-prop-2-enylazanium chloride Traditional Name: allyl-benzyl-(2-chloroethyl)ammonium chloride Formula: C12H17Cl2N MolecularWeight: 246.17608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16ClN.ClH/c1-2-9-14(10-8-13)11-12-6-4-3-5-7-12;/h2-7H,1,8-11H2;1H