4-(3-fluoranylphenoxy)-3-oxidanyl-2-(phenylsulfonyl)oxane-3-carboxylic acid

Systemtic Name: 4-(3-fluoranylphenoxy)-3-oxidanyl-2-(phenylsulfonyl)oxane-3-carboxylic acid Openeye Name: 2-(benzenesulfonyl)-4-(3-fluorophenoxy)-3-hydroxy-tetrahydropyran-3-carboxylic acid CAS Name: 2-(benzenesulfonyl)-4-(3-fluorophenoxy)-3-hydroxy-3-oxanecarboxylic acid IUPAC Name: 2-(benzenesulfonyl)-4-(3-fluorophenoxy)-3-hydroxyoxane-3-carboxylic acid Traditional Name: 2-besyl-4-(3-fluorophenoxy)-3-hydroxy-tetrahydropyran-3-carboxylic acid Formula: C18H17FO7S MolecularWeight: 396.386783

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C(C1OC2=CC(=CC=C2)F)(C(=O)O)O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1COC(C(C1OC2=CC(=CC=C2)F)(C(=O)O)O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H17FO7S/c19-12-5-4-6-13(11-12)26-15-9-10-25-17(18(15,22)16(20)21)27(23,24)14-7-2-1-3-8-14/h1-8,11,15,17,22H,9-10H2,(H,20,21)