[1-[(4-morpholin-4-ylphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(trifluoromethyloxy)benzoate

Systemtic Name: [1-[(4-morpholin-4-ylphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(trifluoromethyloxy)benzoate Openeye Name: [1-methyl-2-(4-morpholinoanilino)-2-oxo-ethyl] 4-(trifluoromethoxy)benzoate CAS Name: 4-(trifluoromethoxy)benzoic acid [1-[4-(4-morpholinyl)anilino]-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-morpholin-4-ylanilino)-1-oxopropan-2-yl] 4-(trifluoromethoxy)benzoate Traditional Name: 4-(trifluoromethoxy)benzoic acid [2-keto-1-methyl-2-(4-morpholinoanilino)ethyl] ester Formula: C21H21F3N2O5 MolecularWeight: 438.39705

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)OC(=O)C3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)OC(=O)C3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C21H21F3N2O5/c1-14(30-20(28)15-2-8-18(9-3-15)31-21(22,23)24)19(27)25-16-4-6-17(7-5-16)26-10-12-29-13-11-26/h2-9,14H,10-13H2,1H3,(H,25,27)