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

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]-5-methyl-2-phenyl-pyrrole-3-carboxylic acid Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]-5-methyl-2-phenyl-pyrrole-3-carboxylic acid CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-5-methyl-2-phenyl-3-pyrrolecarboxylic acid IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]-5-methyl-2-phenylpyrrole-3-carboxylic acid Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]-5-methyl-2-phenyl-pyrrole-3-carboxylic acid Formula: C20H13F6NO2 MolecularWeight: 413.313139

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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)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H13F6NO2/c1-11-7-16(18(28)29)17(12-5-3-2-4-6-12)27(11)15-9-13(19(21,22)23)8-14(10-15)20(24,25)26/h2-10H,1H3,(H,28,29)