1-[3,5-bis(trifluoromethyl)phenyl]-2,5-dimethyl-pyrrole-3-carboxylic acid

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]-2,5-dimethyl-pyrrole-3-carboxylic acid Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]-2,5-dimethyl-pyrrole-3-carboxylic acid CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-2,5-dimethyl-3-pyrrolecarboxylic acid IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]-2,5-dimethylpyrrole-3-carboxylic acid Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]-2,5-dimethyl-pyrrole-3-carboxylic acid Formula: C15H11F6NO2 MolecularWeight: 351.243759

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C)C(=O)O

InChI

InChI=1S/C15H11F6NO2/c1-7-3-12(13(23)24)8(2)22(7)11-5-9(14(16,17)18)4-10(6-11)15(19,20)21/h3-6H,1-2H3,(H,23,24)