6-ethyl-7-[(E)-oct-4-enyl]-1,3,5-trioxepane-2,4-dione

Systemtic Name: 6-ethyl-7-[(E)-oct-4-enyl]-1,3,5-trioxepane-2,4-dione Openeye Name: 6-ethyl-7-[(E)-oct-4-enyl]-1,3,5-trioxepane-2,4-dione CAS Name: 6-ethyl-7-[(E)-oct-4-enyl]-1,3,5-trioxepane-2,4-dione IUPAC Name: 6-ethyl-7-[(E)-oct-4-enyl]-1,3,5-trioxepane-2,4-dione Traditional Name: 6-ethyl-7-[(E)-oct-4-enyl]-1,3,5-trioxepane-2,4-quinone Formula: C14H22O5 MolecularWeight: 270.32148

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=CCCCC1C(OC(=O)OC(=O)O1)CC

Isomeric SMILES

CCC/C=C/CCCC1C(OC(=O)OC(=O)O1)CC

InChI

InChI=1S/C14H22O5/c1-3-5-6-7-8-9-10-12-11(4-2)17-13(15)19-14(16)18-12/h6-7,11-12H,3-5,8-10H2,1-2H3/b7-6+