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

Systemtic Name: (E)-3-(2-azanylpyridin-1-ium-1-yl)-1-(3-methylphenyl)prop-2-en-1-one chloride Openeye Name: (E)-3-(2-aminopyridin-1-ium-1-yl)-1-(m-tolyl)prop-2-en-1-one chloride CAS Name: (E)-3-(2-amino-1-pyridin-1-iumyl)-1-(3-methylphenyl)-2-propen-1-one chloride IUPAC Name: (E)-3-(2-aminopyridin-1-ium-1-yl)-1-(3-methylphenyl)prop-2-en-1-one chloride Traditional Name: (E)-3-(2-aminopyridin-1-ium-1-yl)-1-(m-tolyl)prop-2-en-1-one chloride Formula: C15H15ClN2O MolecularWeight: 274.7454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C=C[N+]2=CC=CC=C2N.[Cl-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)/C=C/[N+]2=CC=CC=C2N.[Cl-]

InChI

InChI=1S/C15H14N2O.ClH/c1-12-5-4-6-13(11-12)14(18)8-10-17-9-3-2-7-15(17)16;/h2-11,16H,1H3;1H/b10-8+;