8-ethanoyl-13-(4-fluoranylphenoxy)-12-oxidanyl-tridec-10-ynoic acid

Systemtic Name: 8-ethanoyl-13-(4-fluoranylphenoxy)-12-oxidanyl-tridec-10-ynoic acid Openeye Name: 8-acetyl-13-(4-fluorophenoxy)-12-hydroxy-tridec-10-ynoic acid CAS Name: 8-acetyl-13-(4-fluorophenoxy)-12-hydroxy-10-tridecynoic acid IUPAC Name: 8-acetyl-13-(4-fluorophenoxy)-12-hydroxytridec-10-ynoic acid Traditional Name: 8-acetyl-13-(4-fluorophenoxy)-12-hydroxy-tridec-10-ynoic acid Formula: C21H27FO5 MolecularWeight: 378.434483

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCCCCCC(=O)O)CC#CC(COC1=CC=C(C=C1)F)O

Isomeric SMILES

CC(=O)C(CCCCCCC(=O)O)CC#CC(COC1=CC=C(C=C1)F)O

InChI

InChI=1S/C21H27FO5/c1-16(23)17(7-4-2-3-5-10-21(25)26)8-6-9-19(24)15-27-20-13-11-18(22)12-14-20/h11-14,17,19,24H,2-5,7-8,10,15H2,1H3,(H,25,26)