4-(2-tert-butylphenoxy)-2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-(2-tert-butylphenoxy)-2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-butanenitrile Openeye Name: 4-(2-tert-butylphenoxy)-2-(1-methylbenzimidazol-2-yl)-3-oxo-butanenitrile CAS Name: 4-(2-tert-butylphenoxy)-2-(1-methyl-2-benzimidazolyl)-3-oxobutanenitrile IUPAC Name: 4-(2-tert-butylphenoxy)-2-(1-methylbenzimidazol-2-yl)-3-oxobutanenitrile Traditional Name: 4-(2-tert-butylphenoxy)-3-keto-2-(1-methylbenzimidazol-2-yl)butyronitrile Formula: C22H23N3O2 MolecularWeight: 361.43692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1OCC(=O)C(C#N)C2=NC3=CC=CC=C3N2C

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1OCC(=O)C(C#N)C2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C22H23N3O2/c1-22(2,3)16-9-5-8-12-20(16)27-14-19(26)15(13-23)21-24-17-10-6-7-11-18(17)25(21)4/h5-12,15H,14H2,1-4H3