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

Systemtic Name: 2,3,4-trimethoxy-N-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Openeye Name: 2,3,4-trimethoxy-N-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide CAS Name: 2,3,4-trimethoxy-N-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide IUPAC Name: 2,3,4-trimethoxy-N-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Traditional Name: N-(2-mesyl-3,4-dihydro-1H-isoquinolin-7-yl)-2,3,4-trimethoxy-benzamide Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C)C=C2)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C)C=C2)OC)OC

InChI

InChI=1S/C20H24N2O6S/c1-26-17-8-7-16(18(27-2)19(17)28-3)20(23)21-15-6-5-13-9-10-22(29(4,24)25)12-14(13)11-15/h5-8,11H,9-10,12H2,1-4H3,(H,21,23)