cycloheptyl 2-chloranyl-4-fluoranyl-5-[3-methyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]benzoate

Systemtic Name: cycloheptyl 2-chloranyl-4-fluoranyl-5-[3-methyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]benzoate Openeye Name: cycloheptyl 2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzoate CAS Name: 2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1-pyrimidinyl]benzoic acid cycloheptyl ester IUPAC Name: cycloheptyl 2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzoate Traditional Name: 2-chloro-5-[2,6-diketo-3-methyl-4-(trifluoromethyl)pyrimidin-1-yl]-4-fluoro-benzoic acid cycloheptyl ester Formula: C20H19ClF4N2O4 MolecularWeight: 462.822473

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C2=C(C=C(C(=C2)C(=O)OC3CCCCCC3)Cl)F)C(F)(F)F

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C2=C(C=C(C(=C2)C(=O)OC3CCCCCC3)Cl)F)C(F)(F)F

InChI

InChI=1S/C20H19ClF4N2O4/c1-26-16(20(23,24)25)10-17(28)27(19(26)30)15-8-12(13(21)9-14(15)22)18(29)31-11-6-4-2-3-5-7-11/h8-11H,2-7H2,1H3