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

Systemtic Name: 3-[[4-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]phenyl]sulfonylamino]-6-phenyl-oxane-3-carboxylic acid Openeye Name: 3-[[4-[(2-chloro-4-fluoro-phenyl)methoxy]phenyl]sulfonylamino]-6-phenyl-tetrahydropyran-3-carboxylic acid CAS Name: 3-[[4-[(2-chloro-4-fluorophenyl)methoxy]phenyl]sulfonylamino]-6-phenyl-3-oxanecarboxylic acid IUPAC Name: 3-[[4-[(2-chloro-4-fluorophenyl)methoxy]phenyl]sulfonylamino]-6-phenyloxane-3-carboxylic acid Traditional Name: 3-[[4-(2-chloro-4-fluoro-benzyl)oxyphenyl]sulfonylamino]-6-phenyl-tetrahydropyran-3-carboxylic acid Formula: C25H23ClFNO6S MolecularWeight: 519.969623

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C25H23ClFNO6S/c26-22-14-19(27)7-6-18(22)15-33-20-8-10-21(11-9-20)35(31,32)28-25(24(29)30)13-12-23(34-16-25)17-4-2-1-3-5-17/h1-11,14,23,28H,12-13,15-16H2,(H,29,30)