3,3-bis(oxidanyl)-5-oxidanylidene-thiane-4-carbonitrile

Systemtic Name: 3,3-bis(oxidanyl)-5-oxidanylidene-thiane-4-carbonitrile Openeye Name: 3,3-dihydroxy-5-oxo-tetrahydrothiopyran-4-carbonitrile CAS Name: 3,3-dihydroxy-5-oxo-4-thianecarbonitrile IUPAC Name: 3,3-dihydroxy-5-oxothiane-4-carbonitrile Traditional Name: 3,3-dihydroxy-5-keto-tetrahydrothiopyran-4-carbonitrile Formula: C6H7NO3S MolecularWeight: 173.18968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(C(CS1)(O)O)C#N

Isomeric SMILES

C1C(=O)C(C(CS1)(O)O)C#N

InChI

InChI=1S/C6H7NO3S/c7-1-4-5(8)2-11-3-6(4,9)10/h4,9-10H,2-3H2