4-(3,5-dimethylphenoxy)-2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-(3,5-dimethylphenoxy)-2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-butanenitrile Openeye Name: 4-(3,5-dimethylphenoxy)-2-(1-methylbenzimidazol-2-yl)-3-oxo-butanenitrile CAS Name: 4-(3,5-dimethylphenoxy)-2-(1-methyl-2-benzimidazolyl)-3-oxobutanenitrile IUPAC Name: 4-(3,5-dimethylphenoxy)-2-(1-methylbenzimidazol-2-yl)-3-oxobutanenitrile Traditional Name: 4-(3,5-dimethylphenoxy)-3-keto-2-(1-methylbenzimidazol-2-yl)butyronitrile Formula: C20H19N3O2 MolecularWeight: 333.38376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)C(C#N)C2=NC3=CC=CC=C3N2C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)C(C#N)C2=NC3=CC=CC=C3N2C)C

InChI

InChI=1S/C20H19N3O2/c1-13-8-14(2)10-15(9-13)25-12-19(24)16(11-21)20-22-17-6-4-5-7-18(17)23(20)3/h4-10,16H,12H2,1-3H3