[1-[5-ethanoyl-2-(3-oxidanylpropyl)phenoxy]-3-(2-fluoranylphenoxy)propan-2-yl] ethanoate

Systemtic Name: [1-[5-ethanoyl-2-(3-oxidanylpropyl)phenoxy]-3-(2-fluoranylphenoxy)propan-2-yl] ethanoate Openeye Name: [1-[[5-acetyl-2-(3-hydroxypropyl)phenoxy]methyl]-2-(2-fluorophenoxy)ethyl] acetate CAS Name: acetic acid [1-[5-acetyl-2-(3-hydroxypropyl)phenoxy]-3-(2-fluorophenoxy)propan-2-yl] ester IUPAC Name: [1-[5-acetyl-2-(3-hydroxypropyl)phenoxy]-3-(2-fluorophenoxy)propan-2-yl] acetate Traditional Name: acetic acid [1-[[5-acetyl-2-(3-hydroxypropyl)phenoxy]methyl]-2-(2-fluorophenoxy)ethyl] ester Formula: C22H25FO6 MolecularWeight: 404.428703

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)CCCO)OCC(COC2=CC=CC=C2F)OC(=O)C

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)CCCO)OCC(COC2=CC=CC=C2F)OC(=O)C

InChI

InChI=1S/C22H25FO6/c1-15(25)18-10-9-17(6-5-11-24)22(12-18)28-14-19(29-16(2)26)13-27-21-8-4-3-7-20(21)23/h3-4,7-10,12,19,24H,5-6,11,13-14H2,1-2H3