(4-phenylmethoxyphenyl) 3-bromanyl-4-methyl-benzoate

Systemtic Name: (4-phenylmethoxyphenyl) 3-bromanyl-4-methyl-benzoate Openeye Name: (4-benzyloxyphenyl) 3-bromo-4-methyl-benzoate CAS Name: 3-bromo-4-methylbenzoic acid (4-phenylmethoxyphenyl) ester IUPAC Name: (4-phenylmethoxyphenyl) 3-bromo-4-methylbenzoate Traditional Name: 3-bromo-4-methyl-benzoic acid (4-benzoxyphenyl) ester Formula: C21H17BrO3 MolecularWeight: 397.26188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3)Br

InChI

InChI=1S/C21H17BrO3/c1-15-7-8-17(13-20(15)22)21(23)25-19-11-9-18(10-12-19)24-14-16-5-3-2-4-6-16/h2-13H,14H2,1H3