methyl 5-[2,6-bis(bromanyl)-4-methyl-phenoxy]-2-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[2,6-bis(bromanyl)-4-methyl-phenoxy]-2-oxidanylidene-pentanoate Openeye Name: methyl 5-(2,6-dibromo-4-methyl-phenoxy)-2-oxo-pentanoate CAS Name: 5-(2,6-dibromo-4-methylphenoxy)-2-oxopentanoic acid methyl ester IUPAC Name: methyl 5-(2,6-dibromo-4-methylphenoxy)-2-oxopentanoate Traditional Name: 5-(2,6-dibromo-4-methyl-phenoxy)-2-keto-valeric acid methyl ester Formula: C13H14Br2O4 MolecularWeight: 394.05586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCCCC(=O)C(=O)OC)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCCCC(=O)C(=O)OC)Br

InChI

InChI=1S/C13H14Br2O4/c1-8-6-9(14)12(10(15)7-8)19-5-3-4-11(16)13(17)18-2/h6-7H,3-5H2,1-2H3