(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 3-(1,3-benzodioxol-5-ylmethylsulfamoyl)benzoate

Systemtic Name: (2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 3-(1,3-benzodioxol-5-ylmethylsulfamoyl)benzoate Openeye Name: (2-oxo-2-pyrrolidin-1-yl-ethyl) 3-(1,3-benzodioxol-5-ylmethylsulfamoyl)benzoate CAS Name: 3-(1,3-benzodioxol-5-ylmethylsulfamoyl)benzoic acid [2-oxo-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyrrolidin-1-ylethyl) 3-(1,3-benzodioxol-5-ylmethylsulfamoyl)benzoate Traditional Name: 3-(piperonylsulfamoyl)benzoic acid (2-keto-2-pyrrolidino-ethyl) ester Formula: C21H22N2O7S MolecularWeight: 446.47358

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCN(C1)C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22N2O7S/c24-20(23-8-1-2-9-23)13-28-21(25)16-4-3-5-17(11-16)31(26,27)22-12-15-6-7-18-19(10-15)30-14-29-18/h3-7,10-11,22H,1-2,8-9,12-14H2