8-ethanoyl-13-(4-fluoranylphenoxy)-12-oxidanyl-tridec-5-ynoic acid

Systemtic Name: 8-ethanoyl-13-(4-fluoranylphenoxy)-12-oxidanyl-tridec-5-ynoic acid Openeye Name: 8-acetyl-13-(4-fluorophenoxy)-12-hydroxy-tridec-5-ynoic acid CAS Name: 8-acetyl-13-(4-fluorophenoxy)-12-hydroxy-5-tridecynoic acid IUPAC Name: 8-acetyl-13-(4-fluorophenoxy)-12-hydroxytridec-5-ynoic acid Traditional Name: 8-acetyl-13-(4-fluorophenoxy)-12-hydroxy-tridec-5-ynoic acid Formula: C21H27FO5 MolecularWeight: 378.434483

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCCC(COC1=CC=C(C=C1)F)O)CC#CCCCC(=O)O

Isomeric SMILES

CC(=O)C(CCCC(COC1=CC=C(C=C1)F)O)CC#CCCCC(=O)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,3,5-10,15H2,1H3,(H,25,26)