methyl 4-morpholin-4-yl-3-[2,2,2-tris(fluoranyl)ethanoylamino]benzoate

Systemtic Name: methyl 4-morpholin-4-yl-3-[2,2,2-tris(fluoranyl)ethanoylamino]benzoate Openeye Name: methyl 4-morpholino-3-[(2,2,2-trifluoroacetyl)amino]benzoate CAS Name: 4-(4-morpholinyl)-3-[(2,2,2-trifluoro-1-oxoethyl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-morpholin-4-yl-3-[(2,2,2-trifluoroacetyl)amino]benzoate Traditional Name: 4-morpholino-3-[(2,2,2-trifluoroacetyl)amino]benzoic acid methyl ester Formula: C14H15F3N2O4 MolecularWeight: 332.27511

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)C(F)(F)F

InChI

InChI=1S/C14H15F3N2O4/c1-22-12(20)9-2-3-11(19-4-6-23-7-5-19)10(8-9)18-13(21)14(15,16)17/h2-3,8H,4-7H2,1H3,(H,18,21)