2-(3,5-dimethylphenoxy)-N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)ethanamide

Systemtic Name: 2-(3,5-dimethylphenoxy)-N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)ethanamide Openeye Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-(3,5-dimethylphenoxy)acetamide CAS Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-(3,5-dimethylphenoxy)acetamide IUPAC Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-(3,5-dimethylphenoxy)acetamide Traditional Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-(3,5-dimethylphenoxy)acetamide Formula: C21H24N2O3 MolecularWeight: 352.42686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NC2=CC3=C(CCN(C3)C(=O)C)C=C2)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NC2=CC3=C(CCN(C3)C(=O)C)C=C2)C

InChI

InChI=1S/C21H24N2O3/c1-14-8-15(2)10-20(9-14)26-13-21(25)22-19-5-4-17-6-7-23(16(3)24)12-18(17)11-19/h4-5,8-11H,6-7,12-13H2,1-3H3,(H,22,25)