ethyl (E)-4-ethoxy-4-oxidanyl-2-oxidanylidene-but-3-enoate

Systemtic Name: ethyl (E)-4-ethoxy-4-oxidanyl-2-oxidanylidene-but-3-enoate Openeye Name: ethyl (E)-4-ethoxy-4-hydroxy-2-oxo-but-3-enoate CAS Name: (E)-4-ethoxy-4-hydroxy-2-oxo-3-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-ethoxy-4-hydroxy-2-oxobut-3-enoate Traditional Name: (E)-4-ethoxy-4-hydroxy-2-keto-but-3-enoic acid ethyl ester Formula: C8H12O5 MolecularWeight: 189.170535

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCO/C(=[13CH]/C(=O)C(=O)OCC)/O

InChI

InChI=1S/C8H12O5/c1-3-12-7(10)5-6(9)8(11)13-4-2/h5,10H,3-4H2,1-2H3/b7-5+/i5+1