(2E)-2-(1,3-benzodioxol-5-ylmethylidene)butane-1,4-diol

Systemtic Name: (2E)-2-(1,3-benzodioxol-5-ylmethylidene)butane-1,4-diol Openeye Name: (2E)-2-(1,3-benzodioxol-5-ylmethylene)butane-1,4-diol CAS Name: (2E)-2-(1,3-benzodioxol-5-ylmethylidene)butane-1,4-diol IUPAC Name: (2E)-2-(1,3-benzodioxol-5-ylmethylidene)butane-1,4-diol Traditional Name: (2E)-2-piperonylidenebutane-1,4-diol Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(CCO)CO

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(\CCO)/CO

InChI

InChI=1S/C12H14O4/c13-4-3-10(7-14)5-9-1-2-11-12(6-9)16-8-15-11/h1-2,5-6,13-14H,3-4,7-8H2/b10-5+