2,3-bis(oxidanyl)propyl 5-oxidanyl-2-[[8-(trifluoromethyl)quinolin-4-yl]amino]benzoate

Systemtic Name: 2,3-bis(oxidanyl)propyl 5-oxidanyl-2-[[8-(trifluoromethyl)quinolin-4-yl]amino]benzoate Openeye Name: 2,3-dihydroxypropyl 5-hydroxy-2-[[8-(trifluoromethyl)-4-quinolyl]amino]benzoate CAS Name: 5-hydroxy-2-[[8-(trifluoromethyl)-4-quinolinyl]amino]benzoic acid 2,3-dihydroxypropyl ester IUPAC Name: 2,3-dihydroxypropyl 5-hydroxy-2-[[8-(trifluoromethyl)quinolin-4-yl]amino]benzoate Traditional Name: 5-hydroxy-2-[[8-(trifluoromethyl)-4-quinolyl]amino]benzoic acid glyceryl ester Formula: C20H17F3N2O5 MolecularWeight: 422.35459

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2C(=C1)C(F)(F)F)NC3=C(C=C(C=C3)O)C(=O)OCC(CO)O

Isomeric SMILES

C1=CC2=C(C=CN=C2C(=C1)C(F)(F)F)NC3=C(C=C(C=C3)O)C(=O)OCC(CO)O

InChI

InChI=1S/C20H17F3N2O5/c21-20(22,23)15-3-1-2-13-17(6-7-24-18(13)15)25-16-5-4-11(27)8-14(16)19(29)30-10-12(28)9-26/h1-8,12,26-28H,9-10H2,(H,24,25)