2-(dibutylamino)ethyl 2-[[8-(trifluoromethyl)quinolin-4-yl]amino]benzoate

Systemtic Name: 2-(dibutylamino)ethyl 2-[[8-(trifluoromethyl)quinolin-4-yl]amino]benzoate Openeye Name: 2-(dibutylamino)ethyl 2-[[8-(trifluoromethyl)-4-quinolyl]amino]benzoate CAS Name: 2-[[8-(trifluoromethyl)-4-quinolinyl]amino]benzoic acid 2-(dibutylamino)ethyl ester IUPAC Name: 2-(dibutylamino)ethyl 2-[[8-(trifluoromethyl)quinolin-4-yl]amino]benzoate Traditional Name: 2-[[8-(trifluoromethyl)-4-quinolyl]amino]benzoic acid 2-(dibutylamino)ethyl ester Formula: C27H32F3N3O2 MolecularWeight: 487.55709

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCOC(=O)C1=CC=CC=C1NC2=C3C=CC=C(C3=NC=C2)C(F)(F)F

Isomeric SMILES

CCCCN(CCCC)CCOC(=O)C1=CC=CC=C1NC2=C3C=CC=C(C3=NC=C2)C(F)(F)F

InChI

InChI=1S/C27H32F3N3O2/c1-3-5-16-33(17-6-4-2)18-19-35-26(34)21-10-7-8-13-23(21)32-24-14-15-31-25-20(24)11-9-12-22(25)27(28,29)30/h7-15H,3-6,16-19H2,1-2H3,(H,31,32)