4-(2-pyridin-4-ylpyrrolidin-1-yl)sulfonylbutanoic acid

Systemtic Name: 4-(2-pyridin-4-ylpyrrolidin-1-yl)sulfonylbutanoic acid Openeye Name: 4-[2-(4-pyridyl)pyrrolidin-1-yl]sulfonylbutanoic acid CAS Name: 4-[(2-pyridin-4-yl-1-pyrrolidinyl)sulfonyl]butanoic acid IUPAC Name: 4-(2-pyridin-4-ylpyrrolidin-1-yl)sulfonylbutanoic acid Traditional Name: 4-[2-(4-pyridyl)pyrrolidino]sulfonylbutyric acid Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)CCCC(=O)O)C2=CC=NC=C2

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)CCCC(=O)O)C2=CC=NC=C2

InChI

InChI=1S/C13H18N2O4S/c16-13(17)4-2-10-20(18,19)15-9-1-3-12(15)11-5-7-14-8-6-11/h5-8,12H,1-4,9-10H2,(H,16,17)