(E)-but-2-ene-1,4-diol; diethyl (E)-but-2-enedioate

Systemtic Name: (E)-but-2-ene-1,4-diol; diethyl (E)-but-2-enedioate Openeye Name: (E)-but-2-ene-1,4-diol; diethyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid diethyl ester; (E)-2-butene-1,4-diol IUPAC Name: (E)-but-2-ene-1,4-diol; diethyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid diethyl ester; (E)-but-2-ene-1,4-diol Formula: C12H20O6 MolecularWeight: 260.2836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)/C=C/C(=O)OCC.C(/C=C/CO)O

InChI

InChI=1S/C8H12O4.C4H8O2/c1-3-11-7(9)5-6-8(10)12-4-2;5-3-1-2-4-6/h5-6H,3-4H2,1-2H3;1-2,5-6H,3-4H2/b6-5+;2-1+