(3R)-1-(3-methylimidazol-3-ium-1-yl)-3-phenyl-butan-1-one chloride

Systemtic Name: (3R)-1-(3-methylimidazol-3-ium-1-yl)-3-phenyl-butan-1-one chloride Openeye Name: (3R)-1-(3-methylimidazol-3-ium-1-yl)-3-phenyl-butan-1-one chloride CAS Name: (3R)-1-(3-methyl-1-imidazol-3-iumyl)-3-phenyl-1-butanone chloride IUPAC Name: (3R)-1-(3-methylimidazol-3-ium-1-yl)-3-phenylbutan-1-one chloride Traditional Name: (3R)-1-(3-methylimidazol-3-ium-1-yl)-3-phenyl-butan-1-one chloride Formula: C14H17ClN2O MolecularWeight: 264.75058

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1C=C[N+](=C1)C)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

C[C@H](CC(=O)N1C=C[N+](=C1)C)C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C14H17N2O.ClH/c1-12(13-6-4-3-5-7-13)10-14(17)16-9-8-15(2)11-16;/h3-9,11-12H,10H2,1-2H3;1H/q+1;/p-1/t12-;/m1./s1