1-[4-(trifluoromethyl)phenyl]ethyl 2-[(7-butan-2-ylquinolin-4-yl)amino]benzoate

Systemtic Name: 1-[4-(trifluoromethyl)phenyl]ethyl 2-[(7-butan-2-ylquinolin-4-yl)amino]benzoate Openeye Name: 1-[4-(trifluoromethyl)phenyl]ethyl 2-[(7-sec-butyl-4-quinolyl)amino]benzoate CAS Name: 2-[(7-butan-2-yl-4-quinolinyl)amino]benzoic acid 1-[4-(trifluoromethyl)phenyl]ethyl ester IUPAC Name: 1-[4-(trifluoromethyl)phenyl]ethyl 2-[(7-butan-2-ylquinolin-4-yl)amino]benzoate Traditional Name: 2-[(7-sec-butyl-4-quinolyl)amino]benzoic acid 1-[4-(trifluoromethyl)phenyl]ethyl ester Formula: C29H27F3N2O2 MolecularWeight: 492.53209

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=NC=CC(=C2C=C1)NC3=CC=CC=C3C(=O)OC(C)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CCC(C)C1=CC2=NC=CC(=C2C=C1)NC3=CC=CC=C3C(=O)OC(C)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C29H27F3N2O2/c1-4-18(2)21-11-14-23-26(15-16-33-27(23)17-21)34-25-8-6-5-7-24(25)28(35)36-19(3)20-9-12-22(13-10-20)29(30,31)32/h5-19H,4H2,1-3H3,(H,33,34)