(E)-4-ethoxy-3-ethoxycarbonyl-2-oxidanylidene-but-3-enoic acid

Systemtic Name: (E)-4-ethoxy-3-ethoxycarbonyl-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-ethoxy-3-ethoxycarbonyl-2-oxo-but-3-enoic acid CAS Name: (E)-4-ethoxy-3-ethoxycarbonyl-2-oxo-3-butenoic acid IUPAC Name: (E)-4-ethoxy-3-ethoxycarbonyl-2-oxobut-3-enoic acid Traditional Name: (E)-3-carbethoxy-4-ethoxy-2-keto-but-3-enoic acid Formula: C9H12O6 MolecularWeight: 216.18798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCO/C=C(\C(=O)C(=O)O)/C(=O)OCC

InChI

InChI=1S/C9H12O6/c1-3-14-5-6(7(10)8(11)12)9(13)15-4-2/h5H,3-4H2,1-2H3,(H,11,12)/b6-5+