[(2S)-6-chloranyl-3-oxidanylidene-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl] ethanoate

Systemtic Name: [(2S)-6-chloranyl-3-oxidanylidene-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl] ethanoate Openeye Name: [(2S)-6-chloro-3-oxo-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl] acetate CAS Name: acetic acid [(2S)-6-chloro-3-oxo-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl] ester IUPAC Name: [(2S)-6-chloro-3-oxo-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl] acetate Traditional Name: acetic acid [(2S)-6-chloro-3-keto-2-(trifluoromethyl)-4H-1,4-benzoxazin-2-yl] ester Formula: C11H7ClF3NO4 MolecularWeight: 309.62579

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(C(=O)NC2=C(O1)C=CC(=C2)Cl)C(F)(F)F

Isomeric SMILES

CC(=O)O[C@@]1(C(=O)NC2=C(O1)C=CC(=C2)Cl)C(F)(F)F

InChI

InChI=1S/C11H7ClF3NO4/c1-5(17)19-10(11(13,14)15)9(18)16-7-4-6(12)2-3-8(7)20-10/h2-4H,1H3,(H,16,18)/t10-/m1/s1