2-bromanyl-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-methoxy-benzamide

Systemtic Name: 2-bromanyl-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-methoxy-benzamide Openeye Name: 2-bromo-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-methoxy-benzamide CAS Name: 2-bromo-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-methoxybenzamide IUPAC Name: 2-bromo-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-methoxybenzamide Traditional Name: 2-bromo-N-(2-esyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-methoxy-benzamide Formula: C19H21BrN2O4S MolecularWeight: 453.35004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=C(C=CC(=C3)OC)Br

Isomeric SMILES

CCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=C(C=CC(=C3)OC)Br

InChI

InChI=1S/C19H21BrN2O4S/c1-3-27(24,25)22-9-8-13-4-5-15(10-14(13)12-22)21-19(23)17-11-16(26-2)6-7-18(17)20/h4-7,10-11H,3,8-9,12H2,1-2H3,(H,21,23)