ethyl 8-ethanoyl-13-(furan-2-ylmethoxy)-12-oxidanyl-tridecanoate

Systemtic Name: ethyl 8-ethanoyl-13-(furan-2-ylmethoxy)-12-oxidanyl-tridecanoate Openeye Name: ethyl 8-acetyl-13-(2-furylmethoxy)-12-hydroxy-tridecanoate CAS Name: 8-acetyl-13-(2-furanylmethoxy)-12-hydroxytridecanoic acid ethyl ester IUPAC Name: ethyl 8-acetyl-13-(furan-2-ylmethoxy)-12-hydroxytridecanoate Traditional Name: 8-acetyl-13-(2-furfuryloxy)-12-hydroxy-tridecanoic acid ethyl ester Formula: C22H36O6 MolecularWeight: 396.51764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCC(CCCC(COCC1=CC=CO1)O)C(=O)C

Isomeric SMILES

CCOC(=O)CCCCCCC(CCCC(COCC1=CC=CO1)O)C(=O)C

InChI

InChI=1S/C22H36O6/c1-3-27-22(25)14-7-5-4-6-10-19(18(2)23)11-8-12-20(24)16-26-17-21-13-9-15-28-21/h9,13,15,19-20,24H,3-8,10-12,14,16-17H2,1-2H3