2-butyl-5-(2,2-dimethyl-1-oxidanyl-propyl)-1H-imidazole-4-carbonitrile

Systemtic Name: 2-butyl-5-(2,2-dimethyl-1-oxidanyl-propyl)-1H-imidazole-4-carbonitrile Openeye Name: 2-butyl-5-(1-hydroxy-2,2-dimethyl-propyl)-1H-imidazole-4-carbonitrile CAS Name: 2-butyl-5-(1-hydroxy-2,2-dimethylpropyl)-1H-imidazole-4-carbonitrile IUPAC Name: 2-butyl-5-(1-hydroxy-2,2-dimethylpropyl)-1H-imidazole-4-carbonitrile Traditional Name: 2-butyl-5-(1-hydroxy-2,2-dimethyl-propyl)-1H-imidazole-4-carbonitrile Formula: C13H21N3O MolecularWeight: 235.32534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1)C(C(C)(C)C)O)C#N

Isomeric SMILES

CCCCC1=NC(=C(N1)C(C(C)(C)C)O)C#N

InChI

InChI=1S/C13H21N3O/c1-5-6-7-10-15-9(8-14)11(16-10)12(17)13(2,3)4/h12,17H,5-7H2,1-4H3,(H,15,16)