ethyl 4-[4-nitro-3-(trifluoromethyl)phenoxy]-2-propan-2-yl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-[4-nitro-3-(trifluoromethyl)phenoxy]-2-propan-2-yl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-isopropyl-4-[4-nitro-3-(trifluoromethyl)phenoxy]thiazole-5-carboxylate CAS Name: 4-[4-nitro-3-(trifluoromethyl)phenoxy]-2-propan-2-yl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-nitro-3-(trifluoromethyl)phenoxy]-2-propan-2-yl-1,3-thiazole-5-carboxylate Traditional Name: 2-isopropyl-4-[4-nitro-3-(trifluoromethyl)phenoxy]thiazole-5-carboxylic acid ethyl ester Formula: C16H15F3N2O5S MolecularWeight: 404.36091

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)C(C)C)OC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)C(C)C)OC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C16H15F3N2O5S/c1-4-25-15(22)12-13(20-14(27-12)8(2)3)26-9-5-6-11(21(23)24)10(7-9)16(17,18)19/h5-8H,4H2,1-3H3