methyl 6-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]carbamoyl]pyridine-3-carboxylate

Systemtic Name: methyl 6-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]carbamoyl]pyridine-3-carboxylate Openeye Name: methyl 6-[[2-morpholino-5-(trifluoromethyl)phenyl]carbamoyl]pyridine-3-carboxylate CAS Name: 6-[[2-(4-morpholinyl)-5-(trifluoromethyl)anilino]-oxomethyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]carbamoyl]pyridine-3-carboxylate Traditional Name: 6-[[2-morpholino-5-(trifluoromethyl)phenyl]carbamoyl]nicotinic acid methyl ester Formula: C19H18F3N3O4 MolecularWeight: 409.35913

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3

Isomeric SMILES

COC(=O)C1=CN=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3

InChI

InChI=1S/C19H18F3N3O4/c1-28-18(27)12-2-4-14(23-11-12)17(26)24-15-10-13(19(20,21)22)3-5-16(15)25-6-8-29-9-7-25/h2-5,10-11H,6-9H2,1H3,(H,24,26)