N-[[4-fluoranyl-2-(trifluoromethyl)phenyl]methyl]-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-[[4-fluoranyl-2-(trifluoromethyl)phenyl]methyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-2-morpholino-5-nitro-benzamide CAS Name: N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[4-fluoro-2-(trifluoromethyl)benzyl]-2-morpholino-5-nitro-benzamide Formula: C19H17F4N3O4 MolecularWeight: 427.349593

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=C(C=C(C=C3)F)C(F)(F)F

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=C(C=C(C=C3)F)C(F)(F)F

InChI

InChI=1S/C19H17F4N3O4/c20-13-2-1-12(16(9-13)19(21,22)23)11-24-18(27)15-10-14(26(28)29)3-4-17(15)25-5-7-30-8-6-25/h1-4,9-10H,5-8,11H2,(H,24,27)