4-fluoranyl-3-(2-pyridin-3-ylpiperidin-1-yl)sulfonyl-benzoic acid

Systemtic Name: 4-fluoranyl-3-(2-pyridin-3-ylpiperidin-1-yl)sulfonyl-benzoic acid Openeye Name: 4-fluoro-3-[[2-(3-pyridyl)-1-piperidyl]sulfonyl]benzoic acid CAS Name: 4-fluoro-3-[[2-(3-pyridinyl)-1-piperidinyl]sulfonyl]benzoic acid IUPAC Name: 4-fluoro-3-(2-pyridin-3-ylpiperidin-1-yl)sulfonylbenzoic acid Traditional Name: 4-fluoro-3-[2-(3-pyridyl)piperidino]sulfonyl-benzoic acid Formula: C17H17FN2O4S MolecularWeight: 364.391283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=CN=CC=C2)S(=O)(=O)C3=C(C=CC(=C3)C(=O)O)F

Isomeric SMILES

C1CCN(C(C1)C2=CN=CC=C2)S(=O)(=O)C3=C(C=CC(=C3)C(=O)O)F

InChI

InChI=1S/C17H17FN2O4S/c18-14-7-6-12(17(21)22)10-16(14)25(23,24)20-9-2-1-5-15(20)13-4-3-8-19-11-13/h3-4,6-8,10-11,15H,1-2,5,9H2,(H,21,22)