(E)-3-(2-azanyl-5-chloranyl-pyridin-1-ium-1-yl)-1-phenyl-prop-2-en-1-one chloride

Systemtic Name: (E)-3-(2-azanyl-5-chloranyl-pyridin-1-ium-1-yl)-1-phenyl-prop-2-en-1-one chloride Openeye Name: (E)-3-(2-amino-5-chloro-pyridin-1-ium-1-yl)-1-phenyl-prop-2-en-1-one chloride CAS Name: (E)-3-(2-amino-5-chloro-1-pyridin-1-iumyl)-1-phenyl-2-propen-1-one chloride IUPAC Name: (E)-3-(2-amino-5-chloropyridin-1-ium-1-yl)-1-phenylprop-2-en-1-one chloride Traditional Name: (E)-3-(2-amino-5-chloro-pyridin-1-ium-1-yl)-1-phenyl-prop-2-en-1-one chloride Formula: C14H12Cl2N2O MolecularWeight: 295.16388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11ClN2O.ClH/c15-12-6-7-14(16)17(10-12)9-8-13(18)11-4-2-1-3-5-11;/h1-10,16H;1H/b9-8+;