2-(2,5-dimethylpyrrol-1-yl)-5-fluoranyl-benzoate

Systemtic Name: 2-(2,5-dimethylpyrrol-1-yl)-5-fluoranyl-benzoate Openeye Name: 2-(2,5-dimethylpyrrol-1-yl)-5-fluoro-benzoate CAS Name: 2-(2,5-dimethyl-1-pyrrolyl)-5-fluorobenzoate IUPAC Name: 2-(2,5-dimethylpyrrol-1-yl)-5-fluorobenzoate Traditional Name: 2-(2,5-dimethylpyrrol-1-yl)-5-fluoro-benzoate Formula: C13H11FNO2- MolecularWeight: 232.230343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12FNO2/c1-8-3-4-9(2)15(8)12-6-5-10(14)7-11(12)13(16)17/h3-7H,1-2H3,(H,16,17)/p-1