3-[4-[4-[4-(oxidanylcarbamoyl)oxan-4-yl]sulfonylphenoxy]phenyl]propanoic acid

Systemtic Name: 3-[4-[4-[4-(oxidanylcarbamoyl)oxan-4-yl]sulfonylphenoxy]phenyl]propanoic acid Openeye Name: 3-[4-[4-[4-(hydroxycarbamoyl)tetrahydropyran-4-yl]sulfonylphenoxy]phenyl]propanoic acid CAS Name: 3-[4-[4-[[4-[(hydroxyamino)-oxomethyl]-4-oxanyl]sulfonyl]phenoxy]phenyl]propanoic acid IUPAC Name: 3-[4-[4-[4-(hydroxycarbamoyl)oxan-4-yl]sulfonylphenoxy]phenyl]propanoic acid Traditional Name: 3-[4-[4-[4-(hydroxycarbamoyl)tetrahydropyran-4-yl]sulfonylphenoxy]phenyl]propionic acid Formula: C21H23NO8S MolecularWeight: 449.47422

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)CCC(=O)O

Isomeric SMILES

C1COCCC1(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)CCC(=O)O

InChI

InChI=1S/C21H23NO8S/c23-19(24)10-3-15-1-4-16(5-2-15)30-17-6-8-18(9-7-17)31(27,28)21(20(25)22-26)11-13-29-14-12-21/h1-2,4-9,26H,3,10-14H2,(H,22,25)(H,23,24)