2-[[4,6-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-5-yl]oxy]-2-phenyl-ethanoic acid

Systemtic Name: 2-[[4,6-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-5-yl]oxy]-2-phenyl-ethanoic acid Openeye Name: 2-[[4,6-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-5-yl]oxy]-2-phenyl-acetic acid CAS Name: 2-[[4,6-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-5-yl]oxy]-2-phenylacetic acid IUPAC Name: 2-[[4,6-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-5-yl]oxy]-2-phenylacetic acid Traditional Name: 2-[4,6-dipropyl-3-(trifluoromethyl)indoxazen-5-yl]oxy-2-phenyl-acetic acid Formula: C22H22F3NO4 MolecularWeight: 421.40959

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C(=C1OC(C3=CC=CC=C3)C(=O)O)CCC)C(=NO2)C(F)(F)F

Isomeric SMILES

CCCC1=CC2=C(C(=C1OC(C3=CC=CC=C3)C(=O)O)CCC)C(=NO2)C(F)(F)F

InChI

InChI=1S/C22H22F3NO4/c1-3-8-14-12-16-17(20(26-30-16)22(23,24)25)15(9-4-2)18(14)29-19(21(27)28)13-10-6-5-7-11-13/h5-7,10-12,19H,3-4,8-9H2,1-2H3,(H,27,28)