5-iodanyl-2-[[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino]benzoic acid

Systemtic Name: 5-iodanyl-2-[[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino]benzoic acid Openeye Name: 5-iodo-2-[[2-methyl-7-(trifluoromethyl)-4-quinolyl]amino]benzoic acid CAS Name: 5-iodo-2-[[2-methyl-7-(trifluoromethyl)-4-quinolinyl]amino]benzoic acid IUPAC Name: 5-iodo-2-[[2-methyl-7-(trifluoromethyl)quinolin-4-yl]amino]benzoic acid Traditional Name: 5-iodo-2-[[2-methyl-7-(trifluoromethyl)-4-quinolyl]amino]benzoic acid Formula: C18H12F3IN2O2 MolecularWeight: 472.19976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2)C(F)(F)F)C(=C1)NC3=C(C=C(C=C3)I)C(=O)O

Isomeric SMILES

CC1=NC2=C(C=CC(=C2)C(F)(F)F)C(=C1)NC3=C(C=C(C=C3)I)C(=O)O

InChI

InChI=1S/C18H12F3IN2O2/c1-9-6-15(24-14-5-3-11(22)8-13(14)17(25)26)12-4-2-10(18(19,20)21)7-16(12)23-9/h2-8H,1H3,(H,23,24)(H,25,26)