[4-[2-(4-chlorophenyl)-2-cyano-ethenyl]-2-methoxy-phenyl] 4-bromanylbenzoate

Systemtic Name: [4-[2-(4-chlorophenyl)-2-cyano-ethenyl]-2-methoxy-phenyl] 4-bromanylbenzoate Openeye Name: [4-[2-(4-chlorophenyl)-2-cyano-vinyl]-2-methoxy-phenyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [4-[2-(4-chlorophenyl)-2-cyanoethenyl]-2-methoxyphenyl] ester IUPAC Name: [4-[2-(4-chlorophenyl)-2-cyanoethenyl]-2-methoxyphenyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [4-[2-(4-chlorophenyl)-2-cyano-vinyl]-2-methoxy-phenyl] ester Formula: C23H15BrClNO3 MolecularWeight: 468.7271

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C2=CC=C(C=C2)Cl)OC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)C2=CC=C(C=C2)Cl)OC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C23H15BrClNO3/c1-28-22-13-15(12-18(14-26)16-5-9-20(25)10-6-16)2-11-21(22)29-23(27)17-3-7-19(24)8-4-17/h2-13H,1H3