8-ethanoyl-13-(3-ethoxyphenoxy)-12-oxidanyl-tridec-5-ynoic acid

Systemtic Name: 8-ethanoyl-13-(3-ethoxyphenoxy)-12-oxidanyl-tridec-5-ynoic acid Openeye Name: 8-acetyl-13-(3-ethoxyphenoxy)-12-hydroxy-tridec-5-ynoic acid CAS Name: 8-acetyl-13-(3-ethoxyphenoxy)-12-hydroxy-5-tridecynoic acid IUPAC Name: 8-acetyl-13-(3-ethoxyphenoxy)-12-hydroxytridec-5-ynoic acid Traditional Name: 8-acetyl-13-(3-ethoxyphenoxy)-12-hydroxy-tridec-5-ynoic acid Formula: C23H32O6 MolecularWeight: 404.49658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC=C1)OCC(CCCC(CC#CCCCC(=O)O)C(=O)C)O

Isomeric SMILES

CCOC1=CC(=CC=C1)OCC(CCCC(CC#CCCCC(=O)O)C(=O)C)O

InChI

InChI=1S/C23H32O6/c1-3-28-21-13-9-14-22(16-21)29-17-20(25)12-8-11-19(18(2)24)10-6-4-5-7-15-23(26)27/h9,13-14,16,19-20,25H,3,5,7-8,10-12,15,17H2,1-2H3,(H,26,27)