ethyl 8-ethanoyl-13-(3-ethanoylphenoxy)-12-oxidanyl-tridecanoate

Systemtic Name: ethyl 8-ethanoyl-13-(3-ethanoylphenoxy)-12-oxidanyl-tridecanoate Openeye Name: ethyl 8-acetyl-13-(3-acetylphenoxy)-12-hydroxy-tridecanoate CAS Name: 8-acetyl-13-(3-acetylphenoxy)-12-hydroxytridecanoic acid ethyl ester IUPAC Name: ethyl 8-acetyl-13-(3-acetylphenoxy)-12-hydroxytridecanoate Traditional Name: 8-acetyl-13-(3-acetylphenoxy)-12-hydroxy-tridecanoic acid ethyl ester Formula: C25H38O6 MolecularWeight: 434.56562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCC(CCCC(COC1=CC=CC(=C1)C(=O)C)O)C(=O)C

Isomeric SMILES

CCOC(=O)CCCCCCC(CCCC(COC1=CC=CC(=C1)C(=O)C)O)C(=O)C

InChI

InChI=1S/C25H38O6/c1-4-30-25(29)16-8-6-5-7-11-21(19(2)26)12-9-14-23(28)18-31-24-15-10-13-22(17-24)20(3)27/h10,13,15,17,21,23,28H,4-9,11-12,14,16,18H2,1-3H3