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

Systemtic Name: 2-[3-[3,5-bis(trifluoromethyl)phenyl]-4-cyano-pyrrol-1-yl]ethanoic acid Openeye Name: 2-[3-[3,5-bis(trifluoromethyl)phenyl]-4-cyano-pyrrol-1-yl]acetic acid CAS Name: 2-[3-[3,5-bis(trifluoromethyl)phenyl]-4-cyano-1-pyrrolyl]acetic acid IUPAC Name: 2-[3-[3,5-bis(trifluoromethyl)phenyl]-4-cyanopyrrol-1-yl]acetic acid Traditional Name: 2-[3-[3,5-bis(trifluoromethyl)phenyl]-4-cyano-pyrrol-1-yl]acetic acid Formula: C15H8F6N2O2 MolecularWeight: 362.226639

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C2=CN(C=C2C#N)CC(=O)O

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C2=CN(C=C2C#N)CC(=O)O

InChI

InChI=1S/C15H8F6N2O2/c16-14(17,18)10-1-8(2-11(3-10)15(19,20)21)12-6-23(7-13(24)25)5-9(12)4-22/h1-3,5-6H,7H2,(H,24,25)