[4-(4-cyanophenyl)phenyl] 4-(4-bromanylphenoxy)butanoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 4-(4-bromanylphenoxy)butanoate Openeye Name: [4-(4-cyanophenyl)phenyl] 4-(4-bromophenoxy)butanoate CAS Name: 4-(4-bromophenoxy)butanoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 4-(4-bromophenoxy)butanoate Traditional Name: 4-(4-bromophenoxy)butyric acid [4-(4-cyanophenyl)phenyl] ester Formula: C23H18BrNO3 MolecularWeight: 436.29792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C2=CC=C(C=C2)OC(=O)CCCOC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC=C1C#N)C2=CC=C(C=C2)OC(=O)CCCOC3=CC=C(C=C3)Br

InChI

InChI=1S/C23H18BrNO3/c24-20-9-13-21(14-10-20)27-15-1-2-23(26)28-22-11-7-19(8-12-22)18-5-3-17(16-25)4-6-18/h3-14H,1-2,15H2