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

Systemtic Name: (E)-3-(2-azanylpyridin-1-ium-1-yl)-1-(4-fluorophenyl)prop-2-en-1-one chloride Openeye Name: (E)-3-(2-aminopyridin-1-ium-1-yl)-1-(4-fluorophenyl)prop-2-en-1-one chloride CAS Name: (E)-3-(2-amino-1-pyridin-1-iumyl)-1-(4-fluorophenyl)-2-propen-1-one chloride IUPAC Name: (E)-3-(2-aminopyridin-1-ium-1-yl)-1-(4-fluorophenyl)prop-2-en-1-one chloride Traditional Name: (E)-3-(2-aminopyridin-1-ium-1-yl)-1-(4-fluorophenyl)prop-2-en-1-one chloride Formula: C14H12ClFN2O MolecularWeight: 278.709283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11FN2O.ClH/c15-12-6-4-11(5-7-12)13(18)8-10-17-9-2-1-3-14(17)16;/h1-10,16H;1H/b10-8+;