3-(1-imidazol-1-yl-3,3-dimethyl-2-oxidanyl-butan-2-yl)benzenecarbonitrile

Systemtic Name: 3-(1-imidazol-1-yl-3,3-dimethyl-2-oxidanyl-butan-2-yl)benzenecarbonitrile Openeye Name: 3-[1-hydroxy-1-(imidazol-1-ylmethyl)-2,2-dimethyl-propyl]benzonitrile CAS Name: 3-[2-hydroxy-1-(1-imidazolyl)-3,3-dimethylbutan-2-yl]benzonitrile IUPAC Name: 3-(2-hydroxy-1-imidazol-1-yl-3,3-dimethylbutan-2-yl)benzonitrile Traditional Name: 3-[1-hydroxy-1-(imidazol-1-ylmethyl)-2,2-dimethyl-propyl]benzonitrile Formula: C16H19N3O MolecularWeight: 269.34156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CN1C=CN=C1)(C2=CC=CC(=C2)C#N)O

Isomeric SMILES

CC(C)(C)C(CN1C=CN=C1)(C2=CC=CC(=C2)C#N)O

InChI

InChI=1S/C16H19N3O/c1-15(2,3)16(20,11-19-8-7-18-12-19)14-6-4-5-13(9-14)10-17/h4-9,12,20H,11H2,1-3H3