4-[1-[5-(oxidanylcarbamoyl)piperidin-3-yl]sulfonylpiperidin-4-yl]benzoic acid

Systemtic Name: 4-[1-[5-(oxidanylcarbamoyl)piperidin-3-yl]sulfonylpiperidin-4-yl]benzoic acid Openeye Name: 4-[1-[[5-(hydroxycarbamoyl)-3-piperidyl]sulfonyl]-4-piperidyl]benzoic acid CAS Name: 4-[1-[[5-[(hydroxyamino)-oxomethyl]-3-piperidinyl]sulfonyl]-4-piperidinyl]benzoic acid IUPAC Name: 4-[1-[5-(hydroxycarbamoyl)piperidin-3-yl]sulfonylpiperidin-4-yl]benzoic acid Traditional Name: 4-[1-[[5-(hydroxycarbamoyl)-3-piperidyl]sulfonyl]-4-piperidyl]benzoic acid Formula: C18H25N3O6S MolecularWeight: 411.4726

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=C(C=C2)C(=O)O)S(=O)(=O)C3CC(CNC3)C(=O)NO

Isomeric SMILES

C1CN(CCC1C2=CC=C(C=C2)C(=O)O)S(=O)(=O)C3CC(CNC3)C(=O)NO

InChI

InChI=1S/C18H25N3O6S/c22-17(20-25)15-9-16(11-19-10-15)28(26,27)21-7-5-13(6-8-21)12-1-3-14(4-2-12)18(23)24/h1-4,13,15-16,19,25H,5-11H2,(H,20,22)(H,23,24)