N-oxidanyl-4-[4-[3-(phenylmethylsulfanyl)propoxy]phenyl]sulfonyl-oxane-4-carboxamide

Systemtic Name: N-oxidanyl-4-[4-[3-(phenylmethylsulfanyl)propoxy]phenyl]sulfonyl-oxane-4-carboxamide Openeye Name: 4-[4-(3-benzylsulfanylpropoxy)phenyl]sulfonyltetrahydropyran-4-carbohydroxamic acid CAS Name: N-hydroxy-4-[4-[3-(phenylmethylthio)propoxy]phenyl]sulfonyl-4-oxanecarboxamide IUPAC Name: 4-[4-(3-benzylsulfanylpropoxy)phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide Traditional Name: 4-[4-[3-(benzylthio)propoxy]phenyl]sulfonyltetrahydropyran-4-carbohydroxamic acid Formula: C22H27NO6S2 MolecularWeight: 465.58288

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OCCCSCC3=CC=CC=C3

Isomeric SMILES

C1COCCC1(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OCCCSCC3=CC=CC=C3

InChI

InChI=1S/C22H27NO6S2/c24-21(23-25)22(11-14-28-15-12-22)31(26,27)20-9-7-19(8-10-20)29-13-4-16-30-17-18-5-2-1-3-6-18/h1-3,5-10,25H,4,11-17H2,(H,23,24)