[2-(trifluoromethyl)phenyl]methyl 2-morpholin-4-yl-5-nitro-benzoate

Systemtic Name: [2-(trifluoromethyl)phenyl]methyl 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: [2-(trifluoromethyl)phenyl]methyl 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid [2-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [2-(trifluoromethyl)phenyl]methyl 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid [2-(trifluoromethyl)benzyl] ester Formula: C19H17F3N2O5 MolecularWeight: 410.34389

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C19H17F3N2O5/c20-19(21,22)16-4-2-1-3-13(16)12-29-18(25)15-11-14(24(26)27)5-6-17(15)23-7-9-28-10-8-23/h1-6,11H,7-10,12H2