3-morpholin-4-ylpropyl 2-[[3-(trifluoromethyl)phenyl]amino]pyridine-3-carboxylate

Systemtic Name: 3-morpholin-4-ylpropyl 2-[[3-(trifluoromethyl)phenyl]amino]pyridine-3-carboxylate Openeye Name: 3-morpholinopropyl 2-[3-(trifluoromethyl)anilino]pyridine-3-carboxylate CAS Name: 2-[3-(trifluoromethyl)anilino]-3-pyridinecarboxylic acid 3-(4-morpholinyl)propyl ester IUPAC Name: 3-morpholin-4-ylpropyl 2-[3-(trifluoromethyl)anilino]pyridine-3-carboxylate Traditional Name: 2-[3-(trifluoromethyl)anilino]nicotinic acid 3-morpholinopropyl ester Formula: C20H22F3N3O3 MolecularWeight: 409.40219

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCOC(=O)C2=C(N=CC=C2)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1COCCN1CCCOC(=O)C2=C(N=CC=C2)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H22F3N3O3/c21-20(22,23)15-4-1-5-16(14-15)25-18-17(6-2-7-24-18)19(27)29-11-3-8-26-9-12-28-13-10-26/h1-2,4-7,14H,3,8-13H2,(H,24,25)