1-ethynyl-5-fluoranyl-4-propan-2-yl-4-(trifluoromethyl)-3,1-benzoxazin-2-one

Systemtic Name: 1-ethynyl-5-fluoranyl-4-propan-2-yl-4-(trifluoromethyl)-3,1-benzoxazin-2-one Openeye Name: 1-ethynyl-5-fluoro-4-isopropyl-4-(trifluoromethyl)-3,1-benzoxazin-2-one CAS Name: 1-ethynyl-5-fluoro-4-propan-2-yl-4-(trifluoromethyl)-3,1-benzoxazin-2-one IUPAC Name: 1-ethynyl-5-fluoro-4-propan-2-yl-4-(trifluoromethyl)-3,1-benzoxazin-2-one Traditional Name: 1-ethynyl-5-fluoro-4-isopropyl-4-(trifluoromethyl)-3,1-benzoxazin-2-one Formula: C14H11F4NO2 MolecularWeight: 301.236253

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C2=C(C=CC=C2F)N(C(=O)O1)C#C)C(F)(F)F

Isomeric SMILES

CC(C)C1(C2=C(C=CC=C2F)N(C(=O)O1)C#C)C(F)(F)F

InChI

InChI=1S/C14H11F4NO2/c1-4-19-10-7-5-6-9(15)11(10)13(8(2)3,14(16,17)18)21-12(19)20/h1,5-8H,2-3H3