2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-propyl-pentanoic acid

Systemtic Name: 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-propyl-pentanoic acid Openeye Name: 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-propyl-pentanoic acid CAS Name: 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-propylpentanoic acid IUPAC Name: 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-propylpentanoic acid Traditional Name: 2-[5,7-dipropyl-3-(trifluoromethyl)indoxazen-6-yl]oxy-2-propyl-valeric acid Formula: C22H30F3NO4 MolecularWeight: 429.47311

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C2C(=C1)C(=NO2)C(F)(F)F)CCC)OC(CCC)(CCC)C(=O)O

Isomeric SMILES

CCCC1=C(C(=C2C(=C1)C(=NO2)C(F)(F)F)CCC)OC(CCC)(CCC)C(=O)O

InChI

InChI=1S/C22H30F3NO4/c1-5-9-14-13-16-18(30-26-19(16)22(23,24)25)15(10-6-2)17(14)29-21(11-7-3,12-8-4)20(27)28/h13H,5-12H2,1-4H3,(H,27,28)