2-(1-methylbenzimidazol-2-yl)-4-(3-methyl-4-propan-2-yl-phenoxy)-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(1-methylbenzimidazol-2-yl)-4-(3-methyl-4-propan-2-yl-phenoxy)-3-oxidanylidene-butanenitrile Openeye Name: 4-(4-isopropyl-3-methyl-phenoxy)-2-(1-methylbenzimidazol-2-yl)-3-oxo-butanenitrile CAS Name: 2-(1-methyl-2-benzimidazolyl)-4-(3-methyl-4-propan-2-ylphenoxy)-3-oxobutanenitrile IUPAC Name: 2-(1-methylbenzimidazol-2-yl)-4-(3-methyl-4-propan-2-ylphenoxy)-3-oxobutanenitrile Traditional Name: 4-(4-isopropyl-3-methyl-phenoxy)-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:

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

Isomeric SMILES

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

InChI

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