N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-methyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-methyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-methyl-5-morpholinosulfonyl-benzamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-methyl-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-methyl-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-methyl-5-morpholinosulfonyl-benzamide Formula: C21H22N2O7S MolecularWeight: 446.47358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC3=CC4=C(C=C3C(=O)C)OCO4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC3=CC4=C(C=C3C(=O)C)OCO4

InChI

InChI=1S/C21H22N2O7S/c1-13-3-4-15(31(26,27)23-5-7-28-8-6-23)9-16(13)21(25)22-18-11-20-19(29-12-30-20)10-17(18)14(2)24/h3-4,9-11H,5-8,12H2,1-2H3,(H,22,25)