4-[2-(pyrrolidin-1-ylsulfonylamino)ethyl]benzoic acid

Systemtic Name: 4-[2-(pyrrolidin-1-ylsulfonylamino)ethyl]benzoic acid Openeye Name: 4-[2-(pyrrolidin-1-ylsulfonylamino)ethyl]benzoic acid CAS Name: 4-[2-(1-pyrrolidinylsulfonylamino)ethyl]benzoic acid IUPAC Name: 4-[2-(pyrrolidin-1-ylsulfonylamino)ethyl]benzoic acid Traditional Name: 4-[2-(pyrrolidinosulfonylamino)ethyl]benzoic acid Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)NCCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)NCCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H18N2O4S/c16-13(17)12-5-3-11(4-6-12)7-8-14-20(18,19)15-9-1-2-10-15/h3-6,14H,1-2,7-10H2,(H,16,17)