1-pyrrolidin-2-ylethyl 2-[[7-(trifluoromethyl)quinolin-4-yl]amino]benzoate

Systemtic Name: 1-pyrrolidin-2-ylethyl 2-[[7-(trifluoromethyl)quinolin-4-yl]amino]benzoate Openeye Name: 1-pyrrolidin-2-ylethyl 2-[[7-(trifluoromethyl)-4-quinolyl]amino]benzoate CAS Name: 2-[[7-(trifluoromethyl)-4-quinolinyl]amino]benzoic acid 1-(2-pyrrolidinyl)ethyl ester IUPAC Name: 1-pyrrolidin-2-ylethyl 2-[[7-(trifluoromethyl)quinolin-4-yl]amino]benzoate Traditional Name: 2-[[7-(trifluoromethyl)-4-quinolyl]amino]benzoic acid 1-pyrrolidin-2-ylethyl ester Formula: C23H22F3N3O2 MolecularWeight: 429.43489

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCN1)OC(=O)C2=CC=CC=C2NC3=C4C=CC(=CC4=NC=C3)C(F)(F)F

Isomeric SMILES

CC(C1CCCN1)OC(=O)C2=CC=CC=C2NC3=C4C=CC(=CC4=NC=C3)C(F)(F)F

InChI

InChI=1S/C23H22F3N3O2/c1-14(18-7-4-11-27-18)31-22(30)17-5-2-3-6-19(17)29-20-10-12-28-21-13-15(23(24,25)26)8-9-16(20)21/h2-3,5-6,8-10,12-14,18,27H,4,7,11H2,1H3,(H,28,29)