(3S)-3-ethoxy-3-[4-[[(3S)-7-(trifluoromethyloxy)-3,4-dihydro-2H-chromen-3-yl]oxy]phenyl]propanoic acid

Systemtic Name: (3S)-3-ethoxy-3-[4-[[(3S)-7-(trifluoromethyloxy)-3,4-dihydro-2H-chromen-3-yl]oxy]phenyl]propanoic acid Openeye Name: (3S)-3-ethoxy-3-[4-[(3S)-7-(trifluoromethoxy)chroman-3-yl]oxyphenyl]propanoic acid CAS Name: (3S)-3-ethoxy-3-[4-[[(3S)-7-(trifluoromethoxy)-3,4-dihydro-2H-1-benzopyran-3-yl]oxy]phenyl]propanoic acid IUPAC Name: (3S)-3-ethoxy-3-[4-[[(3S)-7-(trifluoromethoxy)-3,4-dihydro-2H-chromen-3-yl]oxy]phenyl]propanoic acid Traditional Name: (3S)-3-ethoxy-3-[4-[(3S)-7-(trifluoromethoxy)chroman-3-yl]oxyphenyl]propionic acid Formula: C21H21F3O6 MolecularWeight: 426.38305

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC(=O)O)C1=CC=C(C=C1)OC2CC3=C(C=C(C=C3)OC(F)(F)F)OC2

Isomeric SMILES

CCO[C@@H](CC(=O)O)C1=CC=C(C=C1)O[C@H]2CC3=C(C=C(C=C3)OC(F)(F)F)OC2

InChI

InChI=1S/C21H21F3O6/c1-2-27-19(11-20(25)26)13-3-6-15(7-4-13)29-17-9-14-5-8-16(30-21(22,23)24)10-18(14)28-12-17/h3-8,10,17,19H,2,9,11-12H2,1H3,(H,25,26)/t17-,19-/m0/s1