6-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]sulfanylhexanenitrile

Systemtic Name: 6-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]sulfanylhexanenitrile Openeye Name: 6-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]sulfanylhexanenitrile CAS Name: 6-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]thio]hexanenitrile IUPAC Name: 6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylhexanenitrile Traditional Name: 6-[(3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl)thio]hexanenitrile Formula: C12H21NO5S MolecularWeight: 291.36384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CCC#N)CCSC1C(C(C(C(O1)CO)O)O)O

Isomeric SMILES

C(CCC#N)CCSC1C(C(C(C(O1)CO)O)O)O

InChI

InChI=1S/C12H21NO5S/c13-5-3-1-2-4-6-19-12-11(17)10(16)9(15)8(7-14)18-12/h8-12,14-17H,1-4,6-7H2