(E)-4-oxidanylidene-4-(1-oxidanyloctoxy)but-2-enoate

Systemtic Name: (E)-4-oxidanylidene-4-(1-oxidanyloctoxy)but-2-enoate Openeye Name: (E)-4-(1-hydroxyoctoxy)-4-oxo-but-2-enoate CAS Name: (E)-4-(1-hydroxyoctoxy)-4-oxo-2-butenoate IUPAC Name: (E)-4-(1-hydroxyoctoxy)-4-oxobut-2-enoate Traditional Name: (E)-4-(1-hydroxyoctoxy)-4-keto-but-2-enoate Formula: C12H19O5- MolecularWeight: 243.27626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(O)OC(=O)C=CC(=O)[O-]

Isomeric SMILES

CCCCCCCC(O)OC(=O)/C=C/C(=O)[O-]

InChI

InChI=1S/C12H20O5/c1-2-3-4-5-6-7-11(15)17-12(16)9-8-10(13)14/h8-9,11,15H,2-7H2,1H3,(H,13,14)/p-1/b9-8+