2-(2-pyrrolidin-2-ylethoxy)ethyl 2-[[7-(trifluoromethyl)quinolin-4-yl]amino]benzoate

Systemtic Name: 2-(2-pyrrolidin-2-ylethoxy)ethyl 2-[[7-(trifluoromethyl)quinolin-4-yl]amino]benzoate Openeye Name: 2-(2-pyrrolidin-2-ylethoxy)ethyl 2-[[7-(trifluoromethyl)-4-quinolyl]amino]benzoate CAS Name: 2-[[7-(trifluoromethyl)-4-quinolinyl]amino]benzoic acid 2-[2-(2-pyrrolidinyl)ethoxy]ethyl ester IUPAC Name: 2-(2-pyrrolidin-2-ylethoxy)ethyl 2-[[7-(trifluoromethyl)quinolin-4-yl]amino]benzoate Traditional Name: 2-[[7-(trifluoromethyl)-4-quinolyl]amino]benzoic acid 2-(2-pyrrolidin-2-ylethoxy)ethyl ester Formula: C25H26F3N3O3 MolecularWeight: 473.48745

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)CCOCCOC(=O)C2=CC=CC=C2NC3=C4C=CC(=CC4=NC=C3)C(F)(F)F

Isomeric SMILES

C1CC(NC1)CCOCCOC(=O)C2=CC=CC=C2NC3=C4C=CC(=CC4=NC=C3)C(F)(F)F

InChI

InChI=1S/C25H26F3N3O3/c26-25(27,28)17-7-8-19-22(9-12-30-23(19)16-17)31-21-6-2-1-5-20(21)24(32)34-15-14-33-13-10-18-4-3-11-29-18/h1-2,5-9,12,16,18,29H,3-4,10-11,13-15H2,(H,30,31)