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

Systemtic Name: 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-pyridin-3-yl-ethanoic acid Openeye Name: 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-(3-pyridyl)acetic acid CAS Name: 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-(3-pyridinyl)acetic acid IUPAC Name: 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-pyridin-3-ylacetic acid Traditional Name: 2-[5,7-dipropyl-3-(trifluoromethyl)indoxazen-6-yl]oxy-2-(3-pyridyl)acetic acid Formula: C21H21F3N2O4 MolecularWeight: 422.39765

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C2C(=C1)C(=NO2)C(F)(F)F)CCC)OC(C3=CN=CC=C3)C(=O)O

Isomeric SMILES

CCCC1=C(C(=C2C(=C1)C(=NO2)C(F)(F)F)CCC)OC(C3=CN=CC=C3)C(=O)O

InChI

InChI=1S/C21H21F3N2O4/c1-3-6-12-10-15-18(30-26-19(15)21(22,23)24)14(7-4-2)16(12)29-17(20(27)28)13-8-5-9-25-11-13/h5,8-11,17H,3-4,6-7H2,1-2H3,(H,27,28)