2,5-dimethyl-1-[2,3,4-tris(fluoranyl)phenyl]pyrrole-3-carboxylate

Systemtic Name: 2,5-dimethyl-1-[2,3,4-tris(fluoranyl)phenyl]pyrrole-3-carboxylate Openeye Name: 2,5-dimethyl-1-(2,3,4-trifluorophenyl)pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-(2,3,4-trifluorophenyl)-3-pyrrolecarboxylate IUPAC Name: 2,5-dimethyl-1-(2,3,4-trifluorophenyl)pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-(2,3,4-trifluorophenyl)pyrrole-3-carboxylate Formula: C13H9F3NO2- MolecularWeight: 268.21127

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(C(=C(C=C2)F)F)F)C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=C(C(=C(C=C2)F)F)F)C)C(=O)[O-]

InChI

InChI=1S/C13H10F3NO2/c1-6-5-8(13(18)19)7(2)17(6)10-4-3-9(14)11(15)12(10)16/h3-5H,1-2H3,(H,18,19)/p-1