2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylamino)-N-(5-methoxyquinolin-8-yl)ethanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylamino)-N-(5-methoxyquinolin-8-yl)ethanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylamino)-N-(5-methoxy-8-quinolyl)acetamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylamino)-N-(5-methoxy-8-quinolinyl)acetamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylamino)-N-(5-methoxyquinolin-8-yl)acetamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylmethylamino)-N-(5-methoxy-8-quinolyl)acetamide Formula: C21H21N3O6S MolecularWeight: 443.47294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C=CC=NC2=C(C=C1)NC(=O)CNCS(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1=C2C=CC=NC2=C(C=C1)NC(=O)CNCS(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H21N3O6S/c1-28-17-7-5-16(21-15(17)3-2-8-23-21)24-20(25)12-22-13-31(26,27)14-4-6-18-19(11-14)30-10-9-29-18/h2-8,11,22H,9-10,12-13H2,1H3,(H,24,25)