(E)-1-phenyl-3-pyridin-1-ium-1-yl-prop-2-en-1-one chloride

Systemtic Name: (E)-1-phenyl-3-pyridin-1-ium-1-yl-prop-2-en-1-one chloride Openeye Name: (E)-1-phenyl-3-pyridin-1-ium-1-yl-prop-2-en-1-one chloride CAS Name: (E)-1-phenyl-3-(1-pyridin-1-iumyl)-2-propen-1-one chloride IUPAC Name: (E)-1-phenyl-3-pyridin-1-ium-1-ylprop-2-en-1-one chloride Traditional Name: (E)-1-phenyl-3-pyridin-1-ium-1-yl-prop-2-en-1-one chloride Formula: C14H12ClNO MolecularWeight: 245.70418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12NO.ClH/c16-14(13-7-3-1-4-8-13)9-12-15-10-5-2-6-11-15;/h1-12H;1H/q+1;/p-1/b12-9+;