cyanomethyl-dimethyl-[(E)-3-phenylprop-2-enyl]azanium chloride

Systemtic Name: cyanomethyl-dimethyl-[(E)-3-phenylprop-2-enyl]azanium chloride Openeye Name: [(E)-cinnamyl]-(cyanomethyl)-dimethyl-ammonium chloride CAS Name: cyanomethyl-dimethyl-[(E)-3-phenylprop-2-enyl]ammonium chloride IUPAC Name: cyanomethyl-dimethyl-[(E)-3-phenylprop-2-enyl]azanium chloride Traditional Name: [(E)-cinnamyl]-(cyanomethyl)-dimethyl-ammonium chloride Formula: C13H17ClN2 MolecularWeight: 236.74048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N2.ClH/c1-15(2,12-10-14)11-6-9-13-7-4-3-5-8-13;/h3-9H,11-12H2,1-2H3;1H/q+1;/p-1/b9-6+;