2-[1,4-dimethyl-5-[4-(trifluoromethyl)phenyl]carbonyl-pyrrol-2-yl]propanoic acid

Systemtic Name: 2-[1,4-dimethyl-5-[4-(trifluoromethyl)phenyl]carbonyl-pyrrol-2-yl]propanoic acid Openeye Name: 2-[1,4-dimethyl-5-[4-(trifluoromethyl)benzoyl]pyrrol-2-yl]propanoic acid CAS Name: 2-[1,4-dimethyl-5-[oxo-[4-(trifluoromethyl)phenyl]methyl]-2-pyrrolyl]propanoic acid IUPAC Name: 2-[1,4-dimethyl-5-[4-(trifluoromethyl)benzoyl]pyrrol-2-yl]propanoic acid Traditional Name: 2-[1,4-dimethyl-5-[4-(trifluoromethyl)benzoyl]pyrrol-2-yl]propionic acid Formula: C17H16F3NO3 MolecularWeight: 339.30905

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1)C(C)C(=O)O)C)C(=O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC1=C(N(C(=C1)C(C)C(=O)O)C)C(=O)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C17H16F3NO3/c1-9-8-13(10(2)16(23)24)21(3)14(9)15(22)11-4-6-12(7-5-11)17(18,19)20/h4-8,10H,1-3H3,(H,23,24)