phenyl 4-(4-bromophenyl)-3-cyano-benzoate

Systemtic Name: phenyl 4-(4-bromophenyl)-3-cyano-benzoate Openeye Name: phenyl 4-(4-bromophenyl)-3-cyano-benzoate CAS Name: 4-(4-bromophenyl)-3-cyanobenzoic acid phenyl ester IUPAC Name: phenyl 4-(4-bromophenyl)-3-cyanobenzoate Traditional Name: 4-(4-bromophenyl)-3-cyano-benzoic acid phenyl ester Formula: C20H12BrNO2 MolecularWeight: 378.21878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H12BrNO2/c21-17-9-6-14(7-10-17)19-11-8-15(12-16(19)13-22)20(23)24-18-4-2-1-3-5-18/h1-12H