methyl 4-bromanyl-3,5-bis(phenylmethoxy)benzoate

Systemtic Name: methyl 4-bromanyl-3,5-bis(phenylmethoxy)benzoate Openeye Name: methyl 3,5-dibenzyloxy-4-bromo-benzoate CAS Name: 4-bromo-3,5-bis(phenylmethoxy)benzoic acid methyl ester IUPAC Name: methyl 4-bromo-3,5-bis(phenylmethoxy)benzoate Traditional Name: 3,5-dibenzoxy-4-bromo-benzoic acid methyl ester Formula: C22H19BrO4 MolecularWeight: 427.28786

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C(=C1)OCC2=CC=CC=C2)Br)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=C(C(=C1)OCC2=CC=CC=C2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C22H19BrO4/c1-25-22(24)18-12-19(26-14-16-8-4-2-5-9-16)21(23)20(13-18)27-15-17-10-6-3-7-11-17/h2-13H,14-15H2,1H3