O1-ethyl O4-hexyl (E)-but-2-enedioate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C=CC(=O)OCC

Isomeric SMILES

CCCCCCOC(=O)/C=C/C(=O)OCC

InChI

InChI=1S/C12H20O4/c1-3-5-6-7-10-16-12(14)9-8-11(13)15-4-2/h8-9H,3-7,10H2,1-2H3/b9-8+