3-(2-pyridin-3-ylpyrrolidin-1-yl)sulfonylpropanoic acid

Systemtic Name: 3-(2-pyridin-3-ylpyrrolidin-1-yl)sulfonylpropanoic acid Openeye Name: 3-[2-(3-pyridyl)pyrrolidin-1-yl]sulfonylpropanoic acid CAS Name: 3-[[2-(3-pyridinyl)-1-pyrrolidinyl]sulfonyl]propanoic acid IUPAC Name: 3-(2-pyridin-3-ylpyrrolidin-1-yl)sulfonylpropanoic acid Traditional Name: 3-[2-(3-pyridyl)pyrrolidino]sulfonylpropionic acid Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)CCC(=O)O)C2=CN=CC=C2

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)CCC(=O)O)C2=CN=CC=C2

InChI

InChI=1S/C12H16N2O4S/c15-12(16)5-8-19(17,18)14-7-2-4-11(14)10-3-1-6-13-9-10/h1,3,6,9,11H,2,4-5,7-8H2,(H,15,16)