methyl (E)-9,12,13-triacetyloxyoctadec-2-enoate

Systemtic Name: methyl (E)-9,12,13-triacetyloxyoctadec-2-enoate Openeye Name: methyl (E)-9,12,13-triacetoxyoctadec-2-enoate CAS Name: (E)-9,12,13-triacetyloxy-2-octadecenoic acid methyl ester IUPAC Name: methyl (E)-9,12,13-triacetyloxyoctadec-2-enoate Traditional Name: (E)-9,12,13-triacetoxyoctadec-2-enoic acid methyl ester Formula: C25H42O8 MolecularWeight: 470.59618

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(CCC(CCCCCC=CC(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCC(C(CCC(CCCCC/C=C/C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C25H42O8/c1-6-7-11-15-23(32-20(3)27)24(33-21(4)28)18-17-22(31-19(2)26)14-12-9-8-10-13-16-25(29)30-5/h13,16,22-24H,6-12,14-15,17-18H2,1-5H3/b16-13+