(2R)-2-cyano-2-(3,3-dimethyl-4H-isoquinolin-1-yl)-N-(2,4-dimethylphenyl)ethanamide

Systemtic Name: (2R)-2-cyano-2-(3,3-dimethyl-4H-isoquinolin-1-yl)-N-(2,4-dimethylphenyl)ethanamide Openeye Name: (2R)-2-cyano-2-(3,3-dimethyl-4H-isoquinolin-1-yl)-N-(2,4-dimethylphenyl)acetamide CAS Name: (2R)-2-cyano-2-(3,3-dimethyl-4H-isoquinolin-1-yl)-N-(2,4-dimethylphenyl)acetamide IUPAC Name: (2R)-2-cyano-2-(3,3-dimethyl-4H-isoquinolin-1-yl)-N-(2,4-dimethylphenyl)acetamide Traditional Name: (2R)-2-cyano-2-(3,3-dimethyl-4H-isoquinolin-1-yl)-N-(2,4-dimethylphenyl)acetamide Formula: C22H23N3O MolecularWeight: 345.43752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C#N)C2=NC(CC3=CC=CC=C32)(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)[C@@H](C#N)C2=NC(CC3=CC=CC=C32)(C)C)C

InChI

InChI=1S/C22H23N3O/c1-14-9-10-19(15(2)11-14)24-21(26)18(13-23)20-17-8-6-5-7-16(17)12-22(3,4)25-20/h5-11,18H,12H2,1-4H3,(H,24,26)/t18-/m0/s1