(E)-4-oxidanylidene-4-(2-sulfanylethoxy)but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-(2-sulfanylethoxy)but-2-enoic acid Openeye Name: (E)-4-oxo-4-(2-sulfanylethoxy)but-2-enoic acid CAS Name: (E)-4-(2-mercaptoethoxy)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-oxo-4-(2-sulfanylethoxy)but-2-enoic acid Traditional Name: (E)-4-keto-4-(2-mercaptoethoxy)but-2-enoic acid Formula: C6H8O4S MolecularWeight: 176.19032

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Descriptors Computed from Structure

Canonical SMILES:

C(CS)OC(=O)C=CC(=O)O

Isomeric SMILES

C(CS)OC(=O)/C=C/C(=O)O

InChI

InChI=1S/C6H8O4S/c7-5(8)1-2-6(9)10-3-4-11/h1-2,11H,3-4H2,(H,7,8)/b2-1+