1-[4-[(4-fluorophenyl)methoxy]phenyl]sulfonyl-2-(oxidanylcarbamoyl)piperidine-4-carboxylic acid

Systemtic Name: 1-[4-[(4-fluorophenyl)methoxy]phenyl]sulfonyl-2-(oxidanylcarbamoyl)piperidine-4-carboxylic acid Openeye Name: 1-[4-[(4-fluorophenyl)methoxy]phenyl]sulfonyl-2-(hydroxycarbamoyl)piperidine-4-carboxylic acid CAS Name: 1-[4-[(4-fluorophenyl)methoxy]phenyl]sulfonyl-2-[(hydroxyamino)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[4-[(4-fluorophenyl)methoxy]phenyl]sulfonyl-2-(hydroxycarbamoyl)piperidine-4-carboxylic acid Traditional Name: 1-[4-(4-fluorobenzyl)oxyphenyl]sulfonyl-2-(hydroxycarbamoyl)isonipecotic acid Formula: C20H21FN2O7S MolecularWeight: 452.453343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1C(=O)O)C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(C(CC1C(=O)O)C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN2O7S/c21-15-3-1-13(2-4-15)12-30-16-5-7-17(8-6-16)31(28,29)23-10-9-14(20(25)26)11-18(23)19(24)22-27/h1-8,14,18,27H,9-12H2,(H,22,24)(H,25,26)