3-[[4-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]phenyl]sulfonylamino]-6-pyridin-3-yl-oxane-3-carboxylic acid

Systemtic Name: 3-[[4-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]phenyl]sulfonylamino]-6-pyridin-3-yl-oxane-3-carboxylic acid Openeye Name: 3-[[4-[(2-chloro-4-fluoro-phenyl)methoxy]phenyl]sulfonylamino]-6-(3-pyridyl)tetrahydropyran-3-carboxylic acid CAS Name: 3-[[4-[(2-chloro-4-fluorophenyl)methoxy]phenyl]sulfonylamino]-6-(3-pyridinyl)-3-oxanecarboxylic acid IUPAC Name: 3-[[4-[(2-chloro-4-fluorophenyl)methoxy]phenyl]sulfonylamino]-6-pyridin-3-yloxane-3-carboxylic acid Traditional Name: 3-[[4-(2-chloro-4-fluoro-benzyl)oxyphenyl]sulfonylamino]-6-(3-pyridyl)tetrahydropyran-3-carboxylic acid Formula: C24H22ClFN2O6S MolecularWeight: 520.957683

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(COC1C2=CN=CC=C2)(C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)OCC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1CC(COC1C2=CN=CC=C2)(C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)OCC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C24H22ClFN2O6S/c25-21-12-18(26)4-3-17(21)14-33-19-5-7-20(8-6-19)35(31,32)28-24(23(29)30)10-9-22(34-15-24)16-2-1-11-27-13-16/h1-8,11-13,22,28H,9-10,14-15H2,(H,29,30)