2-[3-[3,5-bis(fluoranyl)phenyl]-4-cyano-pyrrol-1-yl]ethanoic acid

Systemtic Name: 2-[3-[3,5-bis(fluoranyl)phenyl]-4-cyano-pyrrol-1-yl]ethanoic acid Openeye Name: 2-[3-cyano-4-(3,5-difluorophenyl)pyrrol-1-yl]acetic acid CAS Name: 2-[3-cyano-4-(3,5-difluorophenyl)-1-pyrrolyl]acetic acid IUPAC Name: 2-[3-cyano-4-(3,5-difluorophenyl)pyrrol-1-yl]acetic acid Traditional Name: 2-[3-cyano-4-(3,5-difluorophenyl)pyrrol-1-yl]acetic acid Formula: C13H8F2N2O2 MolecularWeight: 262.211626

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1F)F)C2=CN(C=C2C#N)CC(=O)O

Isomeric SMILES

C1=C(C=C(C=C1F)F)C2=CN(C=C2C#N)CC(=O)O

InChI

InChI=1S/C13H8F2N2O2/c14-10-1-8(2-11(15)3-10)12-6-17(7-13(18)19)5-9(12)4-16/h1-3,5-6H,7H2,(H,18,19)