3-[[4-[4-oxidanyl-2-(oxidanylcarbamoyl)piperidin-1-yl]sulfonylphenoxy]methyl]benzoic acid

Systemtic Name: 3-[[4-[4-oxidanyl-2-(oxidanylcarbamoyl)piperidin-1-yl]sulfonylphenoxy]methyl]benzoic acid Openeye Name: 3-[[4-[[4-hydroxy-2-(hydroxycarbamoyl)-1-piperidyl]sulfonyl]phenoxy]methyl]benzoic acid CAS Name: 3-[[4-[[4-hydroxy-2-[(hydroxyamino)-oxomethyl]-1-piperidinyl]sulfonyl]phenoxy]methyl]benzoic acid IUPAC Name: 3-[[4-[4-hydroxy-2-(hydroxycarbamoyl)piperidin-1-yl]sulfonylphenoxy]methyl]benzoic acid Traditional Name: 3-[[4-[4-hydroxy-2-(hydroxycarbamoyl)piperidino]sulfonylphenoxy]methyl]benzoic acid Formula: C20H22N2O8S MolecularWeight: 450.46228

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1O)C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1CN(C(CC1O)C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C20H22N2O8S/c23-15-8-9-22(18(11-15)19(24)21-27)31(28,29)17-6-4-16(5-7-17)30-12-13-2-1-3-14(10-13)20(25)26/h1-7,10,15,18,23,27H,8-9,11-12H2,(H,21,24)(H,25,26)