ethyl 7-[2-chloranyl-6-fluoranyl-4-(trifluoromethyl)phenoxy]-2-methyl-3-oxidanylidene-4H-1,4-benzoxazine-2-carboxylate

Systemtic Name: ethyl 7-[2-chloranyl-6-fluoranyl-4-(trifluoromethyl)phenoxy]-2-methyl-3-oxidanylidene-4H-1,4-benzoxazine-2-carboxylate Openeye Name: ethyl 7-[2-chloro-6-fluoro-4-(trifluoromethyl)phenoxy]-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxylate CAS Name: 7-[2-chloro-6-fluoro-4-(trifluoromethyl)phenoxy]-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-[2-chloro-6-fluoro-4-(trifluoromethyl)phenoxy]-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxylate Traditional Name: 7-[2-chloro-6-fluoro-4-(trifluoromethyl)phenoxy]-3-keto-2-methyl-4H-1,4-benzoxazine-2-carboxylic acid ethyl ester Formula: C19H14ClF4NO5 MolecularWeight: 447.764773

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=O)NC2=C(O1)C=C(C=C2)OC3=C(C=C(C=C3Cl)C(F)(F)F)F)C

Isomeric SMILES

CCOC(=O)C1(C(=O)NC2=C(O1)C=C(C=C2)OC3=C(C=C(C=C3Cl)C(F)(F)F)F)C

InChI

InChI=1S/C19H14ClF4NO5/c1-3-28-17(27)18(2)16(26)25-13-5-4-10(8-14(13)30-18)29-15-11(20)6-9(7-12(15)21)19(22,23)24/h4-8H,3H2,1-2H3,(H,25,26)