6-(hydroxymethyl)-5-oxidanyl-3-[2-[1-(phenylsulfonyl)indol-3-yl]ethoxy]oxan-2-olate

Systemtic Name: 6-(hydroxymethyl)-5-oxidanyl-3-[2-[1-(phenylsulfonyl)indol-3-yl]ethoxy]oxan-2-olate Openeye Name: 3-[2-[1-(benzenesulfonyl)indol-3-yl]ethoxy]-5-hydroxy-6-(hydroxymethyl)tetrahydropyran-2-olate CAS Name: 3-[2-[1-(benzenesulfonyl)-3-indolyl]ethoxy]-5-hydroxy-6-(hydroxymethyl)-2-oxanolate IUPAC Name: 3-[2-[1-(benzenesulfonyl)indol-3-yl]ethoxy]-5-hydroxy-6-(hydroxymethyl)oxan-2-olate Traditional Name: 3-[2-(1-besylindol-3-yl)ethoxy]-5-hydroxy-6-methylol-tetrahydropyran-2-olate Formula: C22H24NO7S- MolecularWeight: 446.49346

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC(C1OCCC2=CN(C3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4)[O-])CO)O

Isomeric SMILES

C1C(C(OC(C1OCCC2=CN(C3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4)[O-])CO)O

InChI

InChI=1S/C22H24NO7S/c24-14-21-19(25)12-20(22(26)30-21)29-11-10-15-13-23(18-9-5-4-8-17(15)18)31(27,28)16-6-2-1-3-7-16/h1-9,13,19-22,24-25H,10-12,14H2/q-1