5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoic acid

Systemtic Name: 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoic acid Openeye Name: 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoic acid CAS Name: 5-(dimethylsulfamoyl)-2-(1-pyrrolidinyl)benzoic acid IUPAC Name: 5-(dimethylsulfamoyl)-2-pyrrolidin-1-ylbenzoic acid Traditional Name: 5-(dimethylsulfamoyl)-2-pyrrolidino-benzoic acid Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)O

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)O

InChI

InChI=1S/C13H18N2O4S/c1-14(2)20(18,19)10-5-6-12(11(9-10)13(16)17)15-7-3-4-8-15/h5-6,9H,3-4,7-8H2,1-2H3,(H,16,17)