N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-methylsulfonyl-benzamide

Systemtic Name: N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-methylsulfonyl-benzamide Openeye Name: N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-methylsulfonyl-benzamide CAS Name: N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-methylsulfonylbenzamide IUPAC Name: N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-methylsulfonylbenzamide Traditional Name: 3-mesyl-N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Formula: C18H20N2O3S MolecularWeight: 344.428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

CN1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C18H20N2O3S/c1-20-9-8-13-6-7-16(10-15(13)12-20)19-18(21)14-4-3-5-17(11-14)24(2,22)23/h3-7,10-11H,8-9,12H2,1-2H3,(H,19,21)