N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3-ethanoylphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3-ethanoylphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: 2-(3-acetyl-N-methylsulfonyl-anilino)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide CAS Name: 2-(3-acetyl-N-methylsulfonylanilino)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide IUPAC Name: 2-(3-acetyl-N-methylsulfonylanilino)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Traditional Name: 2-(3-acetyl-N-mesyl-anilino)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)N(CC(=O)NC2=CC3=C(C=C2)OCCO3)S(=O)(=O)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)N(CC(=O)NC2=CC3=C(C=C2)OCCO3)S(=O)(=O)C

InChI

InChI=1S/C19H20N2O6S/c1-13(22)14-4-3-5-16(10-14)21(28(2,24)25)12-19(23)20-15-6-7-17-18(11-15)27-9-8-26-17/h3-7,10-11H,8-9,12H2,1-2H3,(H,20,23)