4-(2-pyridin-3-ylpyrrolidin-1-yl)benzenesulfonic acid

Systemtic Name: 4-(2-pyridin-3-ylpyrrolidin-1-yl)benzenesulfonic acid Openeye Name: 4-[2-(3-pyridyl)pyrrolidin-1-yl]benzenesulfonic acid CAS Name: 4-[2-(3-pyridinyl)-1-pyrrolidinyl]benzenesulfonic acid IUPAC Name: 4-(2-pyridin-3-ylpyrrolidin-1-yl)benzenesulfonic acid Traditional Name: 4-[2-(3-pyridyl)pyrrolidino]besylic acid Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=CC=C(C=C2)S(=O)(=O)O)C3=CN=CC=C3

Isomeric SMILES

C1CC(N(C1)C2=CC=C(C=C2)S(=O)(=O)O)C3=CN=CC=C3

InChI

InChI=1S/C15H16N2O3S/c18-21(19,20)14-7-5-13(6-8-14)17-10-2-4-15(17)12-3-1-9-16-11-12/h1,3,5-9,11,15H,2,4,10H2,(H,18,19,20)