[4-[(Z)-2-(4-chlorophenyl)-2-cyano-ethenyl]-2-methoxy-phenyl] 5-bromanylfuran-2-carboxylate

Systemtic Name: [4-[(Z)-2-(4-chlorophenyl)-2-cyano-ethenyl]-2-methoxy-phenyl] 5-bromanylfuran-2-carboxylate Openeye Name: [4-[(Z)-2-(4-chlorophenyl)-2-cyano-vinyl]-2-methoxy-phenyl] 5-bromofuran-2-carboxylate CAS Name: 5-bromo-2-furancarboxylic acid [4-[(Z)-2-(4-chlorophenyl)-2-cyanoethenyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(Z)-2-(4-chlorophenyl)-2-cyanoethenyl]-2-methoxyphenyl] 5-bromofuran-2-carboxylate Traditional Name: 5-bromofuran-2-carboxylic acid [4-[(Z)-2-(4-chlorophenyl)-2-cyano-vinyl]-2-methoxy-phenyl] ester Formula: C21H13BrClNO4 MolecularWeight: 458.68922

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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(O3)Br

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C2=CC=C(C=C2)Cl)OC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C21H13BrClNO4/c1-26-19-11-13(10-15(12-24)14-3-5-16(23)6-4-14)2-7-17(19)28-21(25)18-8-9-20(22)27-18/h2-11H,1H3/b15-10+