(E)-4-[(E)-4-(dioxidanyl)but-2-enoxy]but-2-enoic acid

Systemtic Name: (E)-4-[(E)-4-(dioxidanyl)but-2-enoxy]but-2-enoic acid Openeye Name: (E)-4-[(E)-4-hydroperoxybut-2-enoxy]but-2-enoic acid CAS Name: (E)-4-[(E)-4-hydroperoxybut-2-enoxy]-2-butenoic acid IUPAC Name: (E)-4-[(E)-4-hydroperoxybut-2-enoxy]but-2-enoic acid Traditional Name: (E)-4-[(E)-4-hydroperoxybut-2-enoxy]but-2-enoic acid Formula: C8H12O5 MolecularWeight: 188.17788

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Descriptors Computed from Structure

Canonical SMILES:

C(C=CCOO)OCC=CC(=O)O

Isomeric SMILES

C(/C=C/COO)OC/C=C/C(=O)O

InChI

InChI=1S/C8H12O5/c9-8(10)4-3-6-12-5-1-2-7-13-11/h1-4,11H,5-7H2,(H,9,10)/b2-1+,4-3+