(E)-3-(4-azanylpyridin-1-ium-1-yl)-1-(4-ethylphenyl)prop-2-en-1-one chloride

Systemtic Name: (E)-3-(4-azanylpyridin-1-ium-1-yl)-1-(4-ethylphenyl)prop-2-en-1-one chloride Openeye Name: (E)-3-(4-aminopyridin-1-ium-1-yl)-1-(4-ethylphenyl)prop-2-en-1-one chloride CAS Name: (E)-3-(4-amino-1-pyridin-1-iumyl)-1-(4-ethylphenyl)-2-propen-1-one chloride IUPAC Name: (E)-3-(4-aminopyridin-1-ium-1-yl)-1-(4-ethylphenyl)prop-2-en-1-one chloride Traditional Name: (E)-3-(4-aminopyridin-1-ium-1-yl)-1-(4-ethylphenyl)prop-2-en-1-one chloride Formula: C16H17ClN2O MolecularWeight: 288.77198

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C=C[N+]2=CC=C(C=C2)N.[Cl-]

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)/C=C/[N+]2=CC=C(C=C2)N.[Cl-]

InChI

InChI=1S/C16H16N2O.ClH/c1-2-13-3-5-14(6-4-13)16(19)9-12-18-10-7-15(17)8-11-18;/h3-12,17H,2H2,1H3;1H/b12-9+;