2-cyanoethyl-methyl-(phenylmethyl)-prop-2-enyl-azanium chloride

Systemtic Name: 2-cyanoethyl-methyl-(phenylmethyl)-prop-2-enyl-azanium chloride Openeye Name: allyl-benzyl-(2-cyanoethyl)-methyl-ammonium chloride CAS Name: 2-cyanoethyl-methyl-(phenylmethyl)-prop-2-enylammonium chloride IUPAC Name: benzyl-(2-cyanoethyl)-methyl-prop-2-enylazanium chloride Traditional Name: allyl-benzyl-(2-cyanoethyl)-methyl-ammonium chloride Formula: C14H19ClN2 MolecularWeight: 250.76706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N2.ClH/c1-3-11-16(2,12-7-10-15)13-14-8-5-4-6-9-14;/h3-6,8-9H,1,7,11-13H2,2H3;1H/q+1;/p-1