1-(3-phenylimidazol-1-ium-1-yl)propan-2-one chloride

Systemtic Name: 1-(3-phenylimidazol-1-ium-1-yl)propan-2-one chloride Openeye Name: 1-(3-phenylimidazol-1-ium-1-yl)propan-2-one chloride CAS Name: 1-(3-phenyl-1-imidazol-1-iumyl)-2-propanone chloride IUPAC Name: 1-(3-phenylimidazol-1-ium-1-yl)propan-2-one chloride Traditional Name: 1-(3-phenylimidazol-1-ium-1-yl)acetone chloride Formula: C12H13ClN2O MolecularWeight: 236.69742

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C[N+]1=CN(C=C1)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

CC(=O)C[N+]1=CN(C=C1)C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C12H13N2O.ClH/c1-11(15)9-13-7-8-14(10-13)12-5-3-2-4-6-12;/h2-8,10H,9H2,1H3;1H/q+1;/p-1