2-[3-(4-ethanoylphenyl)-2H-imidazol-1-yl]ethanenitrile chloride

Systemtic Name: 2-[3-(4-ethanoylphenyl)-2H-imidazol-1-yl]ethanenitrile chloride Openeye Name: 2-[3-(4-acetylphenyl)-2H-imidazol-1-yl]acetonitrile chloride CAS Name: 2-[3-(4-acetylphenyl)-2H-imidazol-1-yl]acetonitrile chloride IUPAC Name: 2-[3-(4-acetylphenyl)-2H-imidazol-1-yl]acetonitrile chloride Traditional Name: 2-[3-(4-acetylphenyl)-4-imidazolin-1-yl]acetonitrile chloride Formula: C13H13ClN3O- MolecularWeight: 262.71482

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CN(C=C2)CC#N.[Cl-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CN(C=C2)CC#N.[Cl-]

InChI

InChI=1S/C13H13N3O.ClH/c1-11(17)12-2-4-13(5-3-12)16-9-8-15(10-16)7-6-14;/h2-5,8-9H,7,10H2,1H3;1H/p-1