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

Systemtic Name: methyl 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-pyridin-3-yl-ethanoate Openeye Name: methyl 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-(3-pyridyl)acetate CAS Name: 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-(3-pyridinyl)acetic acid methyl ester IUPAC Name: methyl 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-pyridin-3-ylacetate Traditional Name: 2-[5,7-dipropyl-3-(trifluoromethyl)indoxazen-6-yl]oxy-2-(3-pyridyl)acetic acid methyl ester Formula: C22H23F3N2O4 MolecularWeight: 436.42423

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H23F3N2O4/c1-4-7-13-11-16-19(31-27-20(16)22(23,24)25)15(8-5-2)17(13)30-18(21(28)29-3)14-9-6-10-26-12-14/h6,9-12,18H,4-5,7-8H2,1-3H3