(3R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC2=CC=CC=C2CN1S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CNC(=O)[C@H]1CC2=CC=CC=C2CN1S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C19H20N2O5S/c1-20-19(22)16-10-13-4-2-3-5-14(13)12-21(16)27(23,24)15-6-7-17-18(11-15)26-9-8-25-17/h2-7,11,16H,8-10,12H2,1H3,(H,20,22)/t16-/m1/s1