ethyl 2-(3-bromanyl-4-tert-butyl-phenyl)-2-oxidanylidene-ethanoate; ethyl 2-[3-bromanyl-2-(4-iodanylbutyl)phenyl]-2-oxidanylidene-ethanoate

Systemtic Name: ethyl 2-(3-bromanyl-4-tert-butyl-phenyl)-2-oxidanylidene-ethanoate; ethyl 2-[3-bromanyl-2-(4-iodanylbutyl)phenyl]-2-oxidanylidene-ethanoate Openeye Name: ethyl 2-(3-bromo-4-tert-butyl-phenyl)-2-oxo-acetate; ethyl 2-[3-bromo-2-(4-iodobutyl)phenyl]-2-oxo-acetate CAS Name: 2-(3-bromo-4-tert-butylphenyl)-2-oxoacetic acid ethyl ester; 2-[3-bromo-2-(4-iodobutyl)phenyl]-2-oxoacetic acid ethyl ester IUPAC Name: ethyl 2-(3-bromo-4-tert-butylphenyl)-2-oxoacetate; ethyl 2-[3-bromo-2-(4-iodobutyl)phenyl]-2-oxoacetate Traditional Name: 2-(3-bromo-4-tert-butyl-phenyl)-2-keto-acetic acid ethyl ester; 2-[3-bromo-2-(4-iodobutyl)phenyl]-2-keto-acetic acid ethyl ester Formula: C28H33Br2IO6 MolecularWeight: 752.27049

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)C1=CC(=C(C=C1)C(C)(C)C)Br.CCOC(=O)C(=O)C1=C(C(=CC=C1)Br)CCCCI

Isomeric SMILES

CCOC(=O)C(=O)C1=CC(=C(C=C1)C(C)(C)C)Br.CCOC(=O)C(=O)C1=C(C(=CC=C1)Br)CCCCI

InChI

InChI=1S/C14H16BrIO3.C14H17BrO3/c1-2-19-14(18)13(17)11-7-5-8-12(15)10(11)6-3-4-9-16;1-5-18-13(17)12(16)9-6-7-10(11(15)8-9)14(2,3)4/h5,7-8H,2-4,6,9H2,1H3;6-8H,5H2,1-4H3