butyl (E)-12-oxidanyl-19-oxidanylidene-icos-9-enoate

Systemtic Name: butyl (E)-12-oxidanyl-19-oxidanylidene-icos-9-enoate Openeye Name: butyl (E)-12-hydroxy-19-oxo-icos-9-enoate CAS Name: (E)-12-hydroxy-19-oxo-9-eicosenoic acid butyl ester IUPAC Name: butyl (E)-12-hydroxy-19-oxoicos-9-enoate Traditional Name: (E)-12-hydroxy-19-keto-eicos-9-enoic acid butyl ester Formula: C24H44O4 MolecularWeight: 396.60376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CCCCCCCC=CCC(CCCCCCC(=O)C)O

Isomeric SMILES

CCCCOC(=O)CCCCCCC/C=C/CC(CCCCCCC(=O)C)O

InChI

InChI=1S/C24H44O4/c1-3-4-21-28-24(27)20-16-10-8-6-5-7-9-14-18-23(26)19-15-12-11-13-17-22(2)25/h9,14,23,26H,3-8,10-13,15-21H2,1-2H3/b14-9+