2-[3,4,5,6-tetrakis(oxidanyl)-1-oxidanylidene-hexan-2-yl]oxysulfanylethanenitrile

Systemtic Name: 2-[3,4,5,6-tetrakis(oxidanyl)-1-oxidanylidene-hexan-2-yl]oxysulfanylethanenitrile Openeye Name: 2-(1-formyl-2,3,4,5-tetrahydroxy-pentoxy)sulfanylacetonitrile CAS Name: cyanomethanesulfenic acid (3,4,5,6-tetrahydroxy-1-oxohexan-2-yl) ester IUPAC Name: 2-(3,4,5,6-tetrahydroxy-1-oxohexan-2-yl)oxysulfanylacetonitrile Traditional Name: 2-[(1-formyl-2,3,4,5-tetrahydroxy-pentoxy)thio]acetonitrile Formula: C8H13NO6S MolecularWeight: 251.25692

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Descriptors Computed from Structure

Canonical SMILES:

C(C#N)SOC(C=O)C(C(C(CO)O)O)O

Isomeric SMILES

C(C#N)SOC(C=O)C(C(C(CO)O)O)O

InChI

InChI=1S/C8H13NO6S/c9-1-2-16-15-6(4-11)8(14)7(13)5(12)3-10/h4-8,10,12-14H,2-3H2