1,3-benzodioxol-5-yl 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate

Systemtic Name: 1,3-benzodioxol-5-yl 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate Openeye Name: 1,3-benzodioxol-5-yl 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate CAS Name: 5-(dimethylsulfamoyl)-2-(1-pyrrolidinyl)benzoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 5-(dimethylsulfamoyl)-2-pyrrolidin-1-ylbenzoate Traditional Name: 5-(dimethylsulfamoyl)-2-pyrrolidino-benzoic acid 1,3-benzodioxol-5-yl ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H22N2O6S/c1-21(2)29(24,25)15-6-7-17(22-9-3-4-10-22)16(12-15)20(23)28-14-5-8-18-19(11-14)27-13-26-18/h5-8,11-12H,3-4,9-10,13H2,1-2H3