ethyl 7-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2,4-dimethyl-3-oxidanylidene-1,4-benzoxazine-2-carboxylate

Systemtic Name: ethyl 7-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2,4-dimethyl-3-oxidanylidene-1,4-benzoxazine-2-carboxylate Openeye Name: ethyl 7-[2-chloro-4-(trifluoromethyl)phenoxy]-2,4-dimethyl-3-oxo-1,4-benzoxazine-2-carboxylate CAS Name: 7-[2-chloro-4-(trifluoromethyl)phenoxy]-2,4-dimethyl-3-oxo-1,4-benzoxazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-[2-chloro-4-(trifluoromethyl)phenoxy]-2,4-dimethyl-3-oxo-1,4-benzoxazine-2-carboxylate Traditional Name: 7-[2-chloro-4-(trifluoromethyl)phenoxy]-3-keto-2,4-dimethyl-1,4-benzoxazine-2-carboxylic acid ethyl ester Formula: C20H17ClF3NO5 MolecularWeight: 443.80089

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=O)N(C2=C(O1)C=C(C=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)C)C

Isomeric SMILES

CCOC(=O)C1(C(=O)N(C2=C(O1)C=C(C=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)C)C

InChI

InChI=1S/C20H17ClF3NO5/c1-4-28-18(27)19(2)17(26)25(3)14-7-6-12(10-16(14)30-19)29-15-8-5-11(9-13(15)21)20(22,23)24/h5-10H,4H2,1-3H3