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

Systemtic Name: (phenylmethyl) 5-[2,6-bis(bromanyl)-4-methyl-phenoxy]-2-oxidanylidene-pentanoate Openeye Name: benzyl 5-(2,6-dibromo-4-methyl-phenoxy)-2-oxo-pentanoate CAS Name: 5-(2,6-dibromo-4-methylphenoxy)-2-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-(2,6-dibromo-4-methylphenoxy)-2-oxopentanoate Traditional Name: 5-(2,6-dibromo-4-methyl-phenoxy)-2-keto-valeric acid benzyl ester Formula: C19H18Br2O4 MolecularWeight: 470.15182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCCCC(=O)C(=O)OCC2=CC=CC=C2)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCCCC(=O)C(=O)OCC2=CC=CC=C2)Br

InChI

InChI=1S/C19H18Br2O4/c1-13-10-15(20)18(16(21)11-13)24-9-5-8-17(22)19(23)25-12-14-6-3-2-4-7-14/h2-4,6-7,10-11H,5,8-9,12H2,1H3