ethyl 3-[3-chloranyl-2,4-bis(fluoranyl)phenyl]-4-cyano-pyrrole-1-carboxylate

Systemtic Name: ethyl 3-[3-chloranyl-2,4-bis(fluoranyl)phenyl]-4-cyano-pyrrole-1-carboxylate Openeye Name: ethyl 3-(3-chloro-2,4-difluoro-phenyl)-4-cyano-pyrrole-1-carboxylate CAS Name: 3-(3-chloro-2,4-difluorophenyl)-4-cyano-1-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(3-chloro-2,4-difluorophenyl)-4-cyanopyrrole-1-carboxylate Traditional Name: 3-(3-chloro-2,4-difluoro-phenyl)-4-cyano-pyrrole-1-carboxylic acid ethyl ester Formula: C14H9ClF2N2O2 MolecularWeight: 310.683266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C=C(C(=C1)C2=C(C(=C(C=C2)F)Cl)F)C#N

Isomeric SMILES

CCOC(=O)N1C=C(C(=C1)C2=C(C(=C(C=C2)F)Cl)F)C#N

InChI

InChI=1S/C14H9ClF2N2O2/c1-2-21-14(20)19-6-8(5-18)10(7-19)9-3-4-11(16)12(15)13(9)17/h3-4,6-7H,2H2,1H3