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

Systemtic Name: ethyl 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-thiophen-3-yl-ethanoate Openeye Name: ethyl 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-(3-thienyl)acetate CAS Name: 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-(3-thiophenyl)acetic acid ethyl ester IUPAC Name: ethyl 2-[[5,7-dipropyl-3-(trifluoromethyl)-1,2-benzoxazol-6-yl]oxy]-2-thiophen-3-ylacetate Traditional Name: 2-[5,7-dipropyl-3-(trifluoromethyl)indoxazen-6-yl]oxy-2-(3-thienyl)acetic acid ethyl ester Formula: C22H24F3NO4S MolecularWeight: 455.49047

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C2C(=C1)C(=NO2)C(F)(F)F)CCC)OC(C3=CSC=C3)C(=O)OCC

Isomeric SMILES

CCCC1=C(C(=C2C(=C1)C(=NO2)C(F)(F)F)CCC)OC(C3=CSC=C3)C(=O)OCC

InChI

InChI=1S/C22H24F3NO4S/c1-4-7-13-11-16-19(30-26-20(16)22(23,24)25)15(8-5-2)17(13)29-18(21(27)28-6-3)14-9-10-31-12-14/h9-12,18H,4-8H2,1-3H3