(E)-1-(4-bromophenyl)-3-(3-chloranylpyridin-1-ium-1-yl)prop-2-en-1-one chloride

Systemtic Name: (E)-1-(4-bromophenyl)-3-(3-chloranylpyridin-1-ium-1-yl)prop-2-en-1-one chloride Openeye Name: (E)-1-(4-bromophenyl)-3-(3-chloropyridin-1-ium-1-yl)prop-2-en-1-one chloride CAS Name: (E)-1-(4-bromophenyl)-3-(3-chloro-1-pyridin-1-iumyl)-2-propen-1-one chloride IUPAC Name: (E)-1-(4-bromophenyl)-3-(3-chloropyridin-1-ium-1-yl)prop-2-en-1-one chloride Traditional Name: (E)-1-(4-bromophenyl)-3-(3-chloropyridin-1-ium-1-yl)prop-2-en-1-one chloride Formula: C14H10BrCl2NO MolecularWeight: 359.0453

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10BrClNO.ClH/c15-12-5-3-11(4-6-12)14(18)7-9-17-8-1-2-13(16)10-17;/h1-10H;1H/q+1;/p-1/b9-7+;