ethyl 13-(3H-1,2-benzodioxol-6-yloxy)-8-ethanoyl-12-oxidanyl-tridecanoate

Systemtic Name: ethyl 13-(3H-1,2-benzodioxol-6-yloxy)-8-ethanoyl-12-oxidanyl-tridecanoate Openeye Name: ethyl 8-acetyl-13-(3H-1,2-benzodioxol-6-yloxy)-12-hydroxy-tridecanoate CAS Name: 8-acetyl-13-(3H-1,2-benzodioxol-6-yloxy)-12-hydroxytridecanoic acid ethyl ester IUPAC Name: ethyl 8-acetyl-13-(3H-1,2-benzodioxol-6-yloxy)-12-hydroxytridecanoate Traditional Name: 8-acetyl-13-(3H-1,2-benzodioxol-6-yloxy)-12-hydroxy-tridecanoic acid ethyl ester Formula: C24H36O7 MolecularWeight: 436.53844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCC(CCCC(COC1=CC2=C(COO2)C=C1)O)C(=O)C

Isomeric SMILES

CCOC(=O)CCCCCCC(CCCC(COC1=CC2=C(COO2)C=C1)O)C(=O)C

InChI

InChI=1S/C24H36O7/c1-3-28-24(27)12-7-5-4-6-9-19(18(2)25)10-8-11-21(26)17-29-22-14-13-20-16-30-31-23(20)15-22/h13-15,19,21,26H,3-12,16-17H2,1-2H3