(E)-1-(4-methylphenyl)-3-(3-methylpyridin-1-ium-1-yl)prop-2-en-1-one chloride

Systemtic Name: (E)-1-(4-methylphenyl)-3-(3-methylpyridin-1-ium-1-yl)prop-2-en-1-one chloride Openeye Name: (E)-3-(3-methylpyridin-1-ium-1-yl)-1-(p-tolyl)prop-2-en-1-one chloride CAS Name: (E)-1-(4-methylphenyl)-3-(3-methyl-1-pyridin-1-iumyl)-2-propen-1-one chloride IUPAC Name: (E)-1-(4-methylphenyl)-3-(3-methylpyridin-1-ium-1-yl)prop-2-en-1-one chloride Traditional Name: (E)-3-(3-methylpyridin-1-ium-1-yl)-1-(p-tolyl)prop-2-en-1-one chloride Formula: C16H16ClNO MolecularWeight: 273.75734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=C[N+]2=CC=CC(=C2)C.[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C=C/[N+]2=CC=CC(=C2)C.[Cl-]

InChI

InChI=1S/C16H16NO.ClH/c1-13-5-7-15(8-6-13)16(18)9-11-17-10-3-4-14(2)12-17;/h3-12H,1-2H3;1H/q+1;/p-1/b11-9+;