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

Systemtic Name: 2-[3-(4-ethanoylphenyl)-2H-imidazol-1-yl]ethanenitrile Openeye Name: 2-[3-(4-acetylphenyl)-2H-imidazol-1-yl]acetonitrile CAS Name: 2-[3-(4-acetylphenyl)-2H-imidazol-1-yl]acetonitrile IUPAC Name: 2-[3-(4-acetylphenyl)-2H-imidazol-1-yl]acetonitrile Traditional Name: 2-[3-(4-acetylphenyl)-4-imidazolin-1-yl]acetonitrile Formula: C13H13N3O MolecularWeight: 227.26182

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CN(C=C2)CC#N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CN(C=C2)CC#N

InChI

InChI=1S/C13H13N3O/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