(4S)-5-fluoranyl-4-(3-methylbut-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one

Systemtic Name: (4S)-5-fluoranyl-4-(3-methylbut-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one Openeye Name: (4S)-5-fluoro-4-(3-methylbut-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one CAS Name: (4S)-5-fluoro-4-(3-methylbut-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one IUPAC Name: (4S)-5-fluoro-4-(3-methylbut-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one Traditional Name: (4S)-5-fluoro-4-(3-methylbut-1-ynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one Formula: C14H11F4NO2 MolecularWeight: 301.236253

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C#CC1(C2=C(C=CC=C2F)NC(=O)O1)C(F)(F)F

Isomeric SMILES

CC(C)C#C[C@]1(C2=C(C=CC=C2F)NC(=O)O1)C(F)(F)F

InChI

InChI=1S/C14H11F4NO2/c1-8(2)6-7-13(14(16,17)18)11-9(15)4-3-5-10(11)19-12(20)21-13/h3-5,8H,1-2H3,(H,19,20)/t13-/m0/s1