3-[1,4-bis(methylsulfonyl)-3-oxidanyl-butan-2-yl]-1,2-dihydroisoindole-1,3-diol

Systemtic Name: 3-[1,4-bis(methylsulfonyl)-3-oxidanyl-butan-2-yl]-1,2-dihydroisoindole-1,3-diol Openeye Name: 1-[2-hydroxy-3-methylsulfonyl-1-(methylsulfonylmethyl)propyl]isoindoline-1,3-diol CAS Name: 3-[3-hydroxy-1,4-bis(methylsulfonyl)butan-2-yl]-1,2-dihydroisoindole-1,3-diol IUPAC Name: 3-[3-hydroxy-1,4-bis(methylsulfonyl)butan-2-yl]-1,2-dihydroisoindole-1,3-diol Traditional Name: 1-[2-hydroxy-3-mesyl-1-(mesylmethyl)propyl]isoindoline-1,3-diol Formula: C14H21NO7S2 MolecularWeight: 379.44904

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC(C(CS(=O)(=O)C)O)C1(C2=CC=CC=C2C(N1)O)O

Isomeric SMILES

CS(=O)(=O)CC(C(CS(=O)(=O)C)O)C1(C2=CC=CC=C2C(N1)O)O

InChI

InChI=1S/C14H21NO7S2/c1-23(19,20)7-11(12(16)8-24(2,21)22)14(18)10-6-4-3-5-9(10)13(17)15-14/h3-6,11-13,15-18H,7-8H2,1-2H3