3-(7-bromanyl-5-fluoranyl-2,2-dimethyl-1,3-benzodioxol-4-yl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione

Systemtic Name: 3-(7-bromanyl-5-fluoranyl-2,2-dimethyl-1,3-benzodioxol-4-yl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione Openeye Name: 3-(7-bromo-5-fluoro-2,2-dimethyl-1,3-benzodioxol-4-yl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione CAS Name: 3-(7-bromo-5-fluoro-2,2-dimethyl-1,3-benzodioxol-4-yl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione IUPAC Name: 3-(7-bromo-5-fluoro-2,2-dimethyl-1,3-benzodioxol-4-yl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione Traditional Name: 3-(7-bromo-5-fluoro-2,2-dimethyl-1,3-benzodioxol-4-yl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-quinone Formula: C15H11BrF4N2O4 MolecularWeight: 439.156453

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2=C(C=C(C(=C2O1)N3C(=O)C=C(N(C3=O)C)C(F)(F)F)F)Br)C

Isomeric SMILES

CC1(OC2=C(C=C(C(=C2O1)N3C(=O)C=C(N(C3=O)C)C(F)(F)F)F)Br)C

InChI

InChI=1S/C15H11BrF4N2O4/c1-14(2)25-11-6(16)4-7(17)10(12(11)26-14)22-9(23)5-8(15(18,19)20)21(3)13(22)24/h4-5H,1-3H3