(2-bromanyl-4-phenyl-phenyl) 3-(2-phenoxyethoxy)benzoate

Systemtic Name: (2-bromanyl-4-phenyl-phenyl) 3-(2-phenoxyethoxy)benzoate Openeye Name: (2-bromo-4-phenyl-phenyl) 3-(2-phenoxyethoxy)benzoate CAS Name: 3-(2-phenoxyethoxy)benzoic acid (2-bromo-4-phenylphenyl) ester IUPAC Name: (2-bromo-4-phenylphenyl) 3-(2-phenoxyethoxy)benzoate Traditional Name: 3-(2-phenoxyethoxy)benzoic acid (2-bromo-4-phenyl-phenyl) ester Formula: C27H21BrO4 MolecularWeight: 489.35724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3=CC(=CC=C3)OCCOC4=CC=CC=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3=CC(=CC=C3)OCCOC4=CC=CC=C4)Br

InChI

InChI=1S/C27H21BrO4/c28-25-19-21(20-8-3-1-4-9-20)14-15-26(25)32-27(29)22-10-7-13-24(18-22)31-17-16-30-23-11-5-2-6-12-23/h1-15,18-19H,16-17H2