dimethyl-[2-(4-methylphenyl)carbonylprop-2-enyl]azanium chloride

Systemtic Name: dimethyl-[2-(4-methylphenyl)carbonylprop-2-enyl]azanium chloride Openeye Name: dimethyl-[2-(4-methylbenzoyl)allyl]ammonium chloride CAS Name: dimethyl-[2-[(4-methylphenyl)-oxomethyl]prop-2-enyl]ammonium chloride IUPAC Name: dimethyl-[2-(4-methylbenzoyl)prop-2-enyl]azanium chloride Traditional Name: dimethyl(2-p-toluoylallyl)ammonium chloride Formula: C13H18ClNO MolecularWeight: 239.74112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO.ClH/c1-10-5-7-12(8-6-10)13(15)11(2)9-14(3)4;/h5-8H,2,9H2,1,3-4H3;1H