2-[2-(hydroxymethyl)-5,6-dimethyl-benzimidazol-1-yl]ethanenitrile

Systemtic Name: 2-[2-(hydroxymethyl)-5,6-dimethyl-benzimidazol-1-yl]ethanenitrile Openeye Name: 2-[2-(hydroxymethyl)-5,6-dimethyl-benzimidazol-1-yl]acetonitrile CAS Name: 2-[2-(hydroxymethyl)-5,6-dimethyl-1-benzimidazolyl]acetonitrile IUPAC Name: 2-[2-(hydroxymethyl)-5,6-dimethylbenzimidazol-1-yl]acetonitrile Traditional Name: 2-(5,6-dimethyl-2-methylol-benzimidazol-1-yl)acetonitrile Formula: C12H13N3O MolecularWeight: 215.25112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)CO)CC#N

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)CO)CC#N

InChI

InChI=1S/C12H13N3O/c1-8-5-10-11(6-9(8)2)15(4-3-13)12(7-16)14-10/h5-6,16H,4,7H2,1-2H3