1-(4-chlorophenyl)-3-pyridin-1-ium-1-yl-propan-1-one chloride

Systemtic Name: 1-(4-chlorophenyl)-3-pyridin-1-ium-1-yl-propan-1-one chloride Openeye Name: 1-(4-chlorophenyl)-3-pyridin-1-ium-1-yl-propan-1-one chloride CAS Name: 1-(4-chlorophenyl)-3-(1-pyridin-1-iumyl)-1-propanone chloride IUPAC Name: 1-(4-chlorophenyl)-3-pyridin-1-ium-1-ylpropan-1-one chloride Traditional Name: 1-(4-chlorophenyl)-3-pyridin-1-ium-1-yl-propan-1-one chloride Formula: C14H13Cl2NO MolecularWeight: 282.16512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13ClNO.ClH/c15-13-6-4-12(5-7-13)14(17)8-11-16-9-2-1-3-10-16;/h1-7,9-10H,8,11H2;1H/q+1;/p-1