N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-methyl-4-(1-pyrrolidinylsulfonyl)phenoxy]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methyl-4-pyrrolidin-1-ylsulfonylphenoxy)acetamide Traditional Name: 2-(2-methyl-4-pyrrolidinosulfonyl-phenoxy)-N-piperonyl-acetamide Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)OCC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)OCC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H24N2O6S/c1-15-10-17(30(25,26)23-8-2-3-9-23)5-7-18(15)27-13-21(24)22-12-16-4-6-19-20(11-16)29-14-28-19/h4-7,10-11H,2-3,8-9,12-14H2,1H3,(H,22,24)