5-[(2-bromanyl-4-fluoranyl-phenyl)diazenyl]-2,2,5-trimethyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-[(2-bromanyl-4-fluoranyl-phenyl)diazenyl]-2,2,5-trimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-(2-bromo-4-fluoro-phenyl)azo-2,2,5-trimethyl-1,3-dioxane-4,6-dione CAS Name: 5-(2-bromo-4-fluorophenyl)azo-2,2,5-trimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[(2-bromo-4-fluorophenyl)diazenyl]-2,2,5-trimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-(2-bromo-4-fluoro-phenyl)azo-2,2,5-trimethyl-1,3-dioxane-4,6-quinone Formula: C13H12BrFN2O4 MolecularWeight: 359.147783

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)(C)N=NC2=C(C=C(C=C2)F)Br)C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)(C)N=NC2=C(C=C(C=C2)F)Br)C

InChI

InChI=1S/C13H12BrFN2O4/c1-12(2)20-10(18)13(3,11(19)21-12)17-16-9-5-4-7(15)6-8(9)14/h4-6H,1-3H3