2-(4-chloranyl-3-methyl-phenoxy)-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)ethanamide

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)ethanamide Openeye Name: 2-(4-chloro-3-methyl-phenoxy)-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)acetamide CAS Name: 2-(4-chloro-3-methylphenoxy)-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)acetamide IUPAC Name: 2-(4-chloro-3-methylphenoxy)-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)acetamide Traditional Name: 2-(4-chloro-3-methyl-phenoxy)-N-(2-esyl-3,4-dihydro-1H-isoquinolin-7-yl)acetamide Formula: C20H23ClN2O4S MolecularWeight: 422.92562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)COC3=CC(=C(C=C3)Cl)C

Isomeric SMILES

CCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)COC3=CC(=C(C=C3)Cl)C

InChI

InChI=1S/C20H23ClN2O4S/c1-3-28(25,26)23-9-8-15-4-5-17(11-16(15)12-23)22-20(24)13-27-18-6-7-19(21)14(2)10-18/h4-7,10-11H,3,8-9,12-13H2,1-2H3,(H,22,24)