6-[2-chloranyl-6-oxidanylidene-4-(trifluoromethyl)pyrimidin-1-yl]-4-prop-2-ynyl-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-chloranyl-6-oxidanylidene-4-(trifluoromethyl)pyrimidin-1-yl]-4-prop-2-ynyl-1,4-benzoxazin-3-one Openeye Name: 6-[2-chloro-6-oxo-4-(trifluoromethyl)pyrimidin-1-yl]-4-prop-2-ynyl-1,4-benzoxazin-3-one CAS Name: 6-[2-chloro-6-oxo-4-(trifluoromethyl)-1-pyrimidinyl]-4-prop-2-ynyl-1,4-benzoxazin-3-one IUPAC Name: 6-[2-chloro-6-oxo-4-(trifluoromethyl)pyrimidin-1-yl]-4-prop-2-ynyl-1,4-benzoxazin-3-one Traditional Name: 6-[2-chloro-6-keto-4-(trifluoromethyl)pyrimidin-1-yl]-4-propargyl-1,4-benzoxazin-3-one Formula: C16H9ClF3N3O3 MolecularWeight: 383.70917

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C(=O)COC2=C1C=C(C=C2)N3C(=O)C=C(N=C3Cl)C(F)(F)F

Isomeric SMILES

C#CCN1C(=O)COC2=C1C=C(C=C2)N3C(=O)C=C(N=C3Cl)C(F)(F)F

InChI

InChI=1S/C16H9ClF3N3O3/c1-2-5-22-10-6-9(3-4-11(10)26-8-14(22)25)23-13(24)7-12(16(18,19)20)21-15(23)17/h1,3-4,6-7H,5,8H2