(4-methoxyphenyl) 3-bromanyl-4-phenethyloxy-benzoate

Systemtic Name: (4-methoxyphenyl) 3-bromanyl-4-phenethyloxy-benzoate Openeye Name: (4-methoxyphenyl) 3-bromo-4-phenethyloxy-benzoate CAS Name: 3-bromo-4-phenethyloxybenzoic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 3-bromo-4-phenethyloxybenzoate Traditional Name: 3-bromo-4-phenethyloxy-benzoic acid (4-methoxyphenyl) ester Formula: C22H19BrO4 MolecularWeight: 427.28786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)Br

InChI

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