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

Systemtic Name: 2-(2,5-dimethylphenoxy)-N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]ethanamide Openeye Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-(2,5-dimethylphenoxy)acetamide CAS Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-(2,5-dimethylphenoxy)acetamide IUPAC Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-(2,5-dimethylphenoxy)acetamide Traditional Name: N-(2-besyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-(2,5-dimethylphenoxy)acetamide Formula: C25H26N2O4S MolecularWeight: 450.54994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=CC=C4)C=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=CC=C4)C=C2

InChI

InChI=1S/C25H26N2O4S/c1-18-8-9-19(2)24(14-18)31-17-25(28)26-22-11-10-20-12-13-27(16-21(20)15-22)32(29,30)23-6-4-3-5-7-23/h3-11,14-15H,12-13,16-17H2,1-2H3,(H,26,28)