methyl 4-[[2-bromanyl-6-(phenylmethyl)phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[2-bromanyl-6-(phenylmethyl)phenoxy]methyl]benzoate Openeye Name: methyl 4-[(2-benzyl-6-bromo-phenoxy)methyl]benzoate CAS Name: 4-[[2-bromo-6-(phenylmethyl)phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-benzyl-6-bromophenoxy)methyl]benzoate Traditional Name: 4-[(2-benzyl-6-bromo-phenoxy)methyl]benzoic acid methyl ester Formula: C22H19BrO3 MolecularWeight: 411.28846

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC2=C(C=CC=C2Br)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC2=C(C=CC=C2Br)CC3=CC=CC=C3

InChI

InChI=1S/C22H19BrO3/c1-25-22(24)18-12-10-17(11-13-18)15-26-21-19(8-5-9-20(21)23)14-16-6-3-2-4-7-16/h2-13H,14-15H2,1H3