N-[3-(6,7-dimethoxy-1-methyl-isoquinolin-3-yl)phenyl]-N-methylsulfonyl-methanesulfonamide

Systemtic Name: N-[3-(6,7-dimethoxy-1-methyl-isoquinolin-3-yl)phenyl]-N-methylsulfonyl-methanesulfonamide Openeye Name: N-[3-(6,7-dimethoxy-1-methyl-3-isoquinolyl)phenyl]-N-methylsulfonyl-methanesulfonamide CAS Name: N-[3-(6,7-dimethoxy-1-methyl-3-isoquinolinyl)phenyl]-N-methylsulfonylmethanesulfonamide IUPAC Name: N-[3-(6,7-dimethoxy-1-methylisoquinolin-3-yl)phenyl]-N-methylsulfonylmethanesulfonamide Traditional Name: N-[3-(6,7-dimethoxy-1-methyl-3-isoquinolyl)phenyl]-N-mesyl-methanesulfonamide Formula: C20H22N2O6S2 MolecularWeight: 450.52848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC2=CC(=C(C=C12)OC)OC)C3=CC(=CC=C3)N(S(=O)(=O)C)S(=O)(=O)C

Isomeric SMILES

CC1=NC(=CC2=CC(=C(C=C12)OC)OC)C3=CC(=CC=C3)N(S(=O)(=O)C)S(=O)(=O)C

InChI

InChI=1S/C20H22N2O6S2/c1-13-17-12-20(28-3)19(27-2)11-15(17)10-18(21-13)14-7-6-8-16(9-14)22(29(4,23)24)30(5,25)26/h6-12H,1-5H3