3-[(3-pyrrolidin-1-ylsulfonylphenyl)sulfamoyl]benzoate

Systemtic Name: 3-[(3-pyrrolidin-1-ylsulfonylphenyl)sulfamoyl]benzoate Openeye Name: 3-[(3-pyrrolidin-1-ylsulfonylphenyl)sulfamoyl]benzoate CAS Name: 3-[[3-(1-pyrrolidinylsulfonyl)phenyl]sulfamoyl]benzoate IUPAC Name: 3-[(3-pyrrolidin-1-ylsulfonylphenyl)sulfamoyl]benzoate Traditional Name: 3-[(3-pyrrolidinosulfonylphenyl)sulfamoyl]benzoate Formula: C17H17N2O6S2- MolecularWeight: 409.45668

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C17H18N2O6S2/c20-17(21)13-5-3-7-15(11-13)26(22,23)18-14-6-4-8-16(12-14)27(24,25)19-9-1-2-10-19/h3-8,11-12,18H,1-2,9-10H2,(H,20,21)/p-1