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

Systemtic Name: ethyl 13-(3-chloranylphenoxy)-8-ethanoyl-12-oxidanyl-tridecanoate Openeye Name: ethyl 8-acetyl-13-(3-chlorophenoxy)-12-hydroxy-tridecanoate CAS Name: 8-acetyl-13-(3-chlorophenoxy)-12-hydroxytridecanoic acid ethyl ester IUPAC Name: ethyl 8-acetyl-13-(3-chlorophenoxy)-12-hydroxytridecanoate Traditional Name: 8-acetyl-13-(3-chlorophenoxy)-12-hydroxy-tridecanoic acid ethyl ester Formula: C23H35ClO5 MolecularWeight: 426.974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H35ClO5/c1-3-28-23(27)15-7-5-4-6-10-19(18(2)25)11-8-13-21(26)17-29-22-14-9-12-20(24)16-22/h9,12,14,16,19,21,26H,3-8,10-11,13,15,17H2,1-2H3