3-[[2-[2-(trifluoromethyl)phenyl]quinazolin-4-yl]amino]-1H-indazole-5-carboxylic acid

Systemtic Name: 3-[[2-[2-(trifluoromethyl)phenyl]quinazolin-4-yl]amino]-1H-indazole-5-carboxylic acid Openeye Name: 3-[[2-[2-(trifluoromethyl)phenyl]quinazolin-4-yl]amino]-1H-indazole-5-carboxylic acid CAS Name: 3-[[2-[2-(trifluoromethyl)phenyl]-4-quinazolinyl]amino]-1H-indazole-5-carboxylic acid IUPAC Name: 3-[[2-[2-(trifluoromethyl)phenyl]quinazolin-4-yl]amino]-1H-indazole-5-carboxylic acid Traditional Name: 3-[[2-[2-(trifluoromethyl)phenyl]quinazolin-4-yl]amino]-1H-indazole-5-carboxylic acid Formula: C23H14F3N5O2 MolecularWeight: 449.38477

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3C(=N2)NC4=NNC5=C4C=C(C=C5)C(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3C(=N2)NC4=NNC5=C4C=C(C=C5)C(=O)O)C(F)(F)F

InChI

InChI=1S/C23H14F3N5O2/c24-23(25,26)16-7-3-1-5-13(16)19-27-17-8-4-2-6-14(17)20(28-19)29-21-15-11-12(22(32)33)9-10-18(15)30-31-21/h1-11H,(H,32,33)(H2,27,28,29,30,31)