(E)-13-(4-fluoranylphenoxy)-8-(1-hydroxyethyl)-12-oxidanyl-tridec-5-enoic acid

Systemtic Name: (E)-13-(4-fluoranylphenoxy)-8-(1-hydroxyethyl)-12-oxidanyl-tridec-5-enoic acid Openeye Name: (E)-13-(4-fluorophenoxy)-12-hydroxy-8-(1-hydroxyethyl)tridec-5-enoic acid CAS Name: (E)-13-(4-fluorophenoxy)-12-hydroxy-8-(1-hydroxyethyl)-5-tridecenoic acid IUPAC Name: (E)-13-(4-fluorophenoxy)-12-hydroxy-8-(1-hydroxyethyl)tridec-5-enoic acid Traditional Name: (E)-13-(4-fluorophenoxy)-12-hydroxy-8-(1-hydroxyethyl)tridec-5-enoic acid Formula: C21H31FO5 MolecularWeight: 382.466243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C(CCCC(COC1=CC=C(C=C1)F)O)C/C=C/CCCC(=O)O)O

InChI

InChI=1S/C21H31FO5/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/h2,4,11-14,16-17,19,23-24H,3,5-10,15H2,1H3,(H,25,26)/b4-2+