diethyl 2-[3-bromanyl-5,5,5-tris(chloranyl)-2-methyl-pentan-2-yl]propanedioate

Systemtic Name: diethyl 2-[3-bromanyl-5,5,5-tris(chloranyl)-2-methyl-pentan-2-yl]propanedioate Openeye Name: diethyl 2-(2-bromo-4,4,4-trichloro-1,1-dimethyl-butyl)propanedioate CAS Name: 2-(3-bromo-5,5,5-trichloro-2-methylpentan-2-yl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(3-bromo-5,5,5-trichloro-2-methylpentan-2-yl)propanedioate Traditional Name: 2-(2-bromo-4,4,4-trichloro-1,1-dimethyl-butyl)malonic acid diethyl ester Formula: C13H20BrCl3O4 MolecularWeight: 426.5585

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)C(C)(C)C(CC(Cl)(Cl)Cl)Br

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)C(C)(C)C(CC(Cl)(Cl)Cl)Br

InChI

InChI=1S/C13H20BrCl3O4/c1-5-20-10(18)9(11(19)21-6-2)12(3,4)8(14)7-13(15,16)17/h8-9H,5-7H2,1-4H3