2-[2,5-dimethyl-3-[7-(trifluoromethyl)quinolin-4-yl]indol-1-yl]ethanoic acid

Systemtic Name: 2-[2,5-dimethyl-3-[7-(trifluoromethyl)quinolin-4-yl]indol-1-yl]ethanoic acid Openeye Name: 2-[2,5-dimethyl-3-[7-(trifluoromethyl)-4-quinolyl]indol-1-yl]acetic acid CAS Name: 2-[2,5-dimethyl-3-[7-(trifluoromethyl)-4-quinolinyl]-1-indolyl]acetic acid IUPAC Name: 2-[2,5-dimethyl-3-[7-(trifluoromethyl)quinolin-4-yl]indol-1-yl]acetic acid Traditional Name: 2-[2,5-dimethyl-3-[7-(trifluoromethyl)-4-quinolyl]indol-1-yl]acetic acid Formula: C22H17F3N2O2 MolecularWeight: 398.37779

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2C3=C4C=CC(=CC4=NC=C3)C(F)(F)F)C)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C3=C4C=CC(=CC4=NC=C3)C(F)(F)F)C)CC(=O)O

InChI

InChI=1S/C22H17F3N2O2/c1-12-3-6-19-17(9-12)21(13(2)27(19)11-20(28)29)16-7-8-26-18-10-14(22(23,24)25)4-5-15(16)18/h3-10H,11H2,1-2H3,(H,28,29)