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

Systemtic Name: 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-ethyl-pentanoic acid Openeye Name: 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-ethyl-pentanoic acid CAS Name: 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-ethylpentanoic acid IUPAC Name: 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-ethylpentanoic acid Traditional Name: 2-[5,7-dipropyl-3-(trifluoromethyl)indoxazen-6-yl]oxy-2-ethyl-valeric acid Formula: C21H28F3NO4 MolecularWeight: 415.44653

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28F3NO4/c1-5-9-13-12-15-17(29-25-18(15)21(22,23)24)14(10-6-2)16(13)28-20(8-4,11-7-3)19(26)27/h12H,5-11H2,1-4H3,(H,26,27)