1-(4-tert-butylphenyl)-2-(1H-imidazol-1-ium-1-yl)ethanone chloride

Systemtic Name: 1-(4-tert-butylphenyl)-2-(1H-imidazol-1-ium-1-yl)ethanone chloride Openeye Name: 1-(4-tert-butylphenyl)-2-(1H-imidazol-1-ium-1-yl)ethanone chloride CAS Name: 1-(4-tert-butylphenyl)-2-(1H-imidazol-1-ium-1-yl)ethanone chloride IUPAC Name: 1-(4-tert-butylphenyl)-2-(1H-imidazol-1-ium-1-yl)ethanone chloride Traditional Name: 1-(4-tert-butylphenyl)-2-(1H-imidazol-1-ium-1-yl)ethanone chloride Formula: C15H19ClN2O MolecularWeight: 278.77716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O.ClH/c1-15(2,3)13-6-4-12(5-7-13)14(18)10-17-9-8-16-11-17;/h4-9,11H,10H2,1-3H3;1H