4-butyl-3-pyrrolidin-1-yl-5-sulfamoyl-benzoic acid

Systemtic Name: 4-butyl-3-pyrrolidin-1-yl-5-sulfamoyl-benzoic acid Openeye Name: 4-butyl-3-pyrrolidin-1-yl-5-sulfamoyl-benzoic acid CAS Name: 4-butyl-3-(1-pyrrolidinyl)-5-sulfamoylbenzoic acid IUPAC Name: 4-butyl-3-pyrrolidin-1-yl-5-sulfamoylbenzoic acid Traditional Name: 4-butyl-3-pyrrolidino-5-sulfamoyl-benzoic acid Formula: C15H22N2O4S MolecularWeight: 326.41118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C=C1S(=O)(=O)N)C(=O)O)N2CCCC2

Isomeric SMILES

CCCCC1=C(C=C(C=C1S(=O)(=O)N)C(=O)O)N2CCCC2

InChI

InChI=1S/C15H22N2O4S/c1-2-3-6-12-13(17-7-4-5-8-17)9-11(15(18)19)10-14(12)22(16,20)21/h9-10H,2-8H2,1H3,(H,18,19)(H2,16,20,21)