5-chloranyl-2-(1,3-dioxan-2-yl)-4-[3-methyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]benzenecarbonitrile

Systemtic Name: 5-chloranyl-2-(1,3-dioxan-2-yl)-4-[3-methyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]benzenecarbonitrile Openeye Name: 5-chloro-2-(1,3-dioxan-2-yl)-4-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzonitrile CAS Name: 5-chloro-2-(1,3-dioxan-2-yl)-4-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1-pyrimidinyl]benzonitrile IUPAC Name: 5-chloro-2-(1,3-dioxan-2-yl)-4-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzonitrile Traditional Name: 5-chloro-4-[2,6-diketo-3-methyl-4-(trifluoromethyl)pyrimidin-1-yl]-2-(1,3-dioxan-2-yl)benzonitrile Formula: C17H13ClF3N3O4 MolecularWeight: 415.75103

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C2=C(C=C(C(=C2)C3OCCCO3)C#N)Cl)C(F)(F)F

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C2=C(C=C(C(=C2)C3OCCCO3)C#N)Cl)C(F)(F)F

InChI

InChI=1S/C17H13ClF3N3O4/c1-23-13(17(19,20)21)7-14(25)24(16(23)26)12-6-10(9(8-22)5-11(12)18)15-27-3-2-4-28-15/h5-7,15H,2-4H2,1H3