4-(2-imidazol-1-ylcarbonyl-3,3-dimethyl-butyl)benzenecarbonitrile

Systemtic Name: 4-(2-imidazol-1-ylcarbonyl-3,3-dimethyl-butyl)benzenecarbonitrile Openeye Name: 4-[2-(imidazole-1-carbonyl)-3,3-dimethyl-butyl]benzonitrile CAS Name: 4-[2-[1-imidazolyl(oxo)methyl]-3,3-dimethylbutyl]benzonitrile IUPAC Name: 4-[2-(imidazole-1-carbonyl)-3,3-dimethylbutyl]benzonitrile Traditional Name: 4-[2-(imidazole-1-carbonyl)-3,3-dimethyl-butyl]benzonitrile Formula: C17H19N3O MolecularWeight: 281.35226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CC1=CC=C(C=C1)C#N)C(=O)N2C=CN=C2

Isomeric SMILES

CC(C)(C)C(CC1=CC=C(C=C1)C#N)C(=O)N2C=CN=C2

InChI

InChI=1S/C17H19N3O/c1-17(2,3)15(16(21)20-9-8-19-12-20)10-13-4-6-14(11-18)7-5-13/h4-9,12,15H,10H2,1-3H3