dibutyl (E)-but-2-enedioate; ethane-1,2-diol

Systemtic Name: dibutyl (E)-but-2-enedioate; ethane-1,2-diol Openeye Name: dibutyl (E)-but-2-enedioate; ethylene glycol CAS Name: (E)-2-butenedioic acid dibutyl ester; ethane-1,2-diol IUPAC Name: dibutyl (E)-but-2-enedioate; ethane-1,2-diol Traditional Name: (E)-but-2-enedioic acid dibutyl ester; ethylene glycol Formula: C14H26O6 MolecularWeight: 290.35264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C=CC(=O)OCCCC.C(CO)O

Isomeric SMILES

CCCCOC(=O)/C=C/C(=O)OCCCC.C(CO)O

InChI

InChI=1S/C12H20O4.C2H6O2/c1-3-5-9-15-11(13)7-8-12(14)16-10-6-4-2;3-1-2-4/h7-8H,3-6,9-10H2,1-2H3;3-4H,1-2H2/b8-7+;