6-[1,2-bis(oxidanyl)ethyl]-4-methyl-5-oxidanyl-2-propoxy-4-sulfanyl-oxane-2-carboxylate

Systemtic Name: 6-[1,2-bis(oxidanyl)ethyl]-4-methyl-5-oxidanyl-2-propoxy-4-sulfanyl-oxane-2-carboxylate Openeye Name: 6-(1,2-dihydroxyethyl)-5-hydroxy-4-methyl-2-propoxy-4-sulfanyl-tetrahydropyran-2-carboxylate CAS Name: 6-(1,2-dihydroxyethyl)-5-hydroxy-4-mercapto-4-methyl-2-propoxy-2-oxanecarboxylate IUPAC Name: 6-(1,2-dihydroxyethyl)-5-hydroxy-4-methyl-2-propoxy-4-sulfanyloxane-2-carboxylate Traditional Name: 6-(1,2-dihydroxyethyl)-5-hydroxy-4-mercapto-4-methyl-2-propoxy-tetrahydropyran-2-carboxylate Formula: C12H21O7S- MolecularWeight: 309.35594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1(CC(C(C(O1)C(CO)O)O)(C)S)C(=O)[O-]

Isomeric SMILES

CCCOC1(CC(C(C(O1)C(CO)O)O)(C)S)C(=O)[O-]

InChI

InChI=1S/C12H22O7S/c1-3-4-18-12(10(16)17)6-11(2,20)9(15)8(19-12)7(14)5-13/h7-9,13-15,20H,3-6H2,1-2H3,(H,16,17)/p-1