3-azanyl-2-(4-phenoxyphenyl)-6-(trifluoromethyl)quinoline-4-carboxylic acid

Systemtic Name: 3-azanyl-2-(4-phenoxyphenyl)-6-(trifluoromethyl)quinoline-4-carboxylic acid Openeye Name: 3-amino-2-(4-phenoxyphenyl)-6-(trifluoromethyl)quinoline-4-carboxylic acid CAS Name: 3-amino-2-(4-phenoxyphenyl)-6-(trifluoromethyl)-4-quinolinecarboxylic acid IUPAC Name: 3-amino-2-(4-phenoxyphenyl)-6-(trifluoromethyl)quinoline-4-carboxylic acid Traditional Name: 3-amino-2-(4-phenoxyphenyl)-6-(trifluoromethyl)cinchoninic acid Formula: C23H15F3N2O3 MolecularWeight: 424.37201

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=C(C(=C4C=C(C=CC4=N3)C(F)(F)F)C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=C(C(=C4C=C(C=CC4=N3)C(F)(F)F)C(=O)O)N

InChI

InChI=1S/C23H15F3N2O3/c24-23(25,26)14-8-11-18-17(12-14)19(22(29)30)20(27)21(28-18)13-6-9-16(10-7-13)31-15-4-2-1-3-5-15/h1-12H,27H2,(H,29,30)