methyl 4-[[2,4-bis(bromanyl)-6-phenethyl-phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[2,4-bis(bromanyl)-6-phenethyl-phenoxy]methyl]benzoate Openeye Name: methyl 4-[(2,4-dibromo-6-phenethyl-phenoxy)methyl]benzoate CAS Name: 4-[(2,4-dibromo-6-phenethylphenoxy)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2,4-dibromo-6-phenethylphenoxy)methyl]benzoate Traditional Name: 4-[(2,4-dibromo-6-phenethyl-phenoxy)methyl]benzoic acid methyl ester Formula: C23H20Br2O3 MolecularWeight: 504.2111

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC2=C(C=C(C=C2CCC3=CC=CC=C3)Br)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC2=C(C=C(C=C2CCC3=CC=CC=C3)Br)Br

InChI

InChI=1S/C23H20Br2O3/c1-27-23(26)18-10-8-17(9-11-18)15-28-22-19(13-20(24)14-21(22)25)12-7-16-5-3-2-4-6-16/h2-6,8-11,13-14H,7,12,15H2,1H3