(E)-2-(4-tert-butylperoxybutyl)but-2-enedioate

Systemtic Name: (E)-2-(4-tert-butylperoxybutyl)but-2-enedioate Openeye Name: (E)-2-(4-tert-butylperoxybutyl)but-2-enedioate CAS Name: (E)-2-(4-tert-butyldioxybutyl)-2-butenedioate IUPAC Name: (E)-2-(4-tert-butylperoxybutyl)but-2-enedioate Traditional Name: (E)-2-(4-tert-butylperoxybutyl)but-2-enedioate Formula: C12H18O6-2 MolecularWeight: 258.26772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OOCCCCC(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(C)(C)OOCCCC/C(=C\C(=O)[O-])/C(=O)[O-]

InChI

InChI=1S/C12H20O6/c1-12(2,3)18-17-7-5-4-6-9(11(15)16)8-10(13)14/h8H,4-7H2,1-3H3,(H,13,14)(H,15,16)/p-2/b9-8+