N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-morpholinosulfonyl-benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-morpholin-4-ylsulfonylbenzamide Traditional Name: 2-methyl-5-morpholinosulfonyl-N-piperonyl-benzamide Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H22N2O6S/c1-14-2-4-16(29(24,25)22-6-8-26-9-7-22)11-17(14)20(23)21-12-15-3-5-18-19(10-15)28-13-27-18/h2-5,10-11H,6-9,12-13H2,1H3,(H,21,23)