[(E)-3-chloranylbut-2-enyl]-dimethyl-(phenylmethyl)azanium chloride

Systemtic Name: [(E)-3-chloranylbut-2-enyl]-dimethyl-(phenylmethyl)azanium chloride Openeye Name: benzyl-[(E)-3-chlorobut-2-enyl]-dimethyl-ammonium chloride CAS Name: [(E)-3-chlorobut-2-enyl]-dimethyl-(phenylmethyl)ammonium chloride IUPAC Name: benzyl-[(E)-3-chlorobut-2-enyl]-dimethylazanium chloride Traditional Name: benzyl-[(E)-3-chlorobut-2-enyl]-dimethyl-ammonium chloride Formula: C13H19Cl2N MolecularWeight: 260.20266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=C\C[N+](C)(C)CC1=CC=CC=C1)/Cl.[Cl-]

InChI

InChI=1S/C13H19ClN.ClH/c1-12(14)9-10-15(2,3)11-13-7-5-4-6-8-13;/h4-9H,10-11H2,1-3H3;1H/q+1;/p-1/b12-9+;