3-[2-(4-oxidanylbutan-2-yl)benzimidazol-1-yl]propanenitrile

Systemtic Name: 3-[2-(4-oxidanylbutan-2-yl)benzimidazol-1-yl]propanenitrile Openeye Name: 3-[2-(3-hydroxy-1-methyl-propyl)benzimidazol-1-yl]propanenitrile CAS Name: 3-[2-(4-hydroxybutan-2-yl)-1-benzimidazolyl]propanenitrile IUPAC Name: 3-[2-(4-hydroxybutan-2-yl)benzimidazol-1-yl]propanenitrile Traditional Name: 3-[2-(3-hydroxy-1-methyl-propyl)benzimidazol-1-yl]propionitrile Formula: C14H17N3O MolecularWeight: 243.30428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCO)C1=NC2=CC=CC=C2N1CCC#N

Isomeric SMILES

CC(CCO)C1=NC2=CC=CC=C2N1CCC#N

InChI

InChI=1S/C14H17N3O/c1-11(7-10-18)14-16-12-5-2-3-6-13(12)17(14)9-4-8-15/h2-3,5-6,11,18H,4,7,9-10H2,1H3