4-ethoxy-2-[4-ethoxy-1-oxidanyl-1,4-bis(oxidanylidene)butan-2-yl]sulfanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-ethoxy-2-[4-ethoxy-1-oxidanyl-1,4-bis(oxidanylidene)butan-2-yl]sulfanyl-4-oxidanylidene-butanoic acid Openeye Name: 2-(1-carboxy-3-ethoxy-3-oxo-propyl)sulfanyl-4-ethoxy-4-oxo-butanoic acid CAS Name: 4-ethoxy-2-[(4-ethoxy-1-hydroxy-1,4-dioxobutan-2-yl)thio]-4-oxobutanoic acid IUPAC Name: 4-ethoxy-2-(4-ethoxy-1-hydroxy-1,4-dioxobutan-2-yl)sulfanyl-4-oxobutanoic acid Traditional Name: 2-[(1-carboxy-3-ethoxy-3-keto-propyl)thio]-4-ethoxy-4-keto-butyric acid Formula: C12H18O8S MolecularWeight: 322.33152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(=O)O)SC(CC(=O)OCC)C(=O)O

Isomeric SMILES

CCOC(=O)CC(C(=O)O)SC(CC(=O)OCC)C(=O)O

InChI

InChI=1S/C12H18O8S/c1-3-19-9(13)5-7(11(15)16)21-8(12(17)18)6-10(14)20-4-2/h7-8H,3-6H2,1-2H3,(H,15,16)(H,17,18)