N-(6-ethanoyl-1,3-benzodioxol-5-yl)-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-morpholinosulfonyl-benzamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-morpholinosulfonyl-benzamide Formula: C20H20N2O7S MolecularWeight: 432.447

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)OCO2

InChI

InChI=1S/C20H20N2O7S/c1-13(23)16-10-18-19(29-12-28-18)11-17(16)21-20(24)14-3-2-4-15(9-14)30(25,26)22-5-7-27-8-6-22/h2-4,9-11H,5-8,12H2,1H3,(H,21,24)