O1-butyl O4-tert-butyl (E)-but-2-enedioate

Systemtic Name: O1-butyl O4-tert-butyl (E)-but-2-enedioate Openeye Name: O1-butyl O4-tert-butyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-butyl ester O4-tert-butyl ester IUPAC Name: 1-O-butyl 4-O-tert-butyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-butyl ester O4-tert-butyl ester Formula: C12H20O4 MolecularWeight: 228.2848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C=CC(=O)OC(C)(C)C

Isomeric SMILES

CCCCOC(=O)/C=C/C(=O)OC(C)(C)C

InChI

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