6-chloranyl-4-(2-cyclopropylethynyl)-8-fluoranyl-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one

Systemtic Name: 6-chloranyl-4-(2-cyclopropylethynyl)-8-fluoranyl-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one Openeye Name: 6-chloro-4-(2-cyclopropylethynyl)-8-fluoro-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one CAS Name: 6-chloro-4-(2-cyclopropylethynyl)-8-fluoro-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one IUPAC Name: 6-chloro-4-(2-cyclopropylethynyl)-8-fluoro-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one Traditional Name: 6-chloro-4-(2-cyclopropylethynyl)-8-fluoro-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one Formula: C14H8ClF4NO2 MolecularWeight: 333.665433

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C#CC2(C3=CC(=CC(=C3NC(=O)O2)F)Cl)C(F)(F)F

Isomeric SMILES

C1CC1C#CC2(C3=CC(=CC(=C3NC(=O)O2)F)Cl)C(F)(F)F

InChI

InChI=1S/C14H8ClF4NO2/c15-8-5-9-11(10(16)6-8)20-12(21)22-13(9,14(17,18)19)4-3-7-1-2-7/h5-7H,1-2H2,(H,20,21)