[2,3,4,5,6-pentakis(bromanyl)phenyl]methyl 2-methylbutanoate

Systemtic Name: [2,3,4,5,6-pentakis(bromanyl)phenyl]methyl 2-methylbutanoate Openeye Name: (2,3,4,5,6-pentabromophenyl)methyl 2-methylbutanoate CAS Name: 2-methylbutanoic acid (2,3,4,5,6-pentabromophenyl)methyl ester IUPAC Name: (2,3,4,5,6-pentabromophenyl)methyl 2-methylbutanoate Traditional Name: 2-methylbutyric acid (2,3,4,5,6-pentabromobenzyl) ester Formula: C12H11Br5O2 MolecularWeight: 586.73454

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OCC1=C(C(=C(C(=C1Br)Br)Br)Br)Br

Isomeric SMILES

CCC(C)C(=O)OCC1=C(C(=C(C(=C1Br)Br)Br)Br)Br

InChI

InChI=1S/C12H11Br5O2/c1-3-5(2)12(18)19-4-6-7(13)9(15)11(17)10(16)8(6)14/h5H,3-4H2,1-2H3