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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2C(=O)C)OCO3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2C(=O)C)OCO3)S(=O)(=O)N4CCOCC4

InChI

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