N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-3,5-dinitro-benzamide

Systemtic Name: N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-3,5-dinitro-benzamide Openeye Name: N-[2-morpholino-5-(trifluoromethyl)phenyl]-3,5-dinitro-benzamide CAS Name: N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]-3,5-dinitrobenzamide IUPAC Name: N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-3,5-dinitrobenzamide Traditional Name: N-[2-morpholino-5-(trifluoromethyl)phenyl]-3,5-dinitro-benzamide Formula: C18H15F3N4O6 MolecularWeight: 440.33011

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15F3N4O6/c19-18(20,21)12-1-2-16(23-3-5-31-6-4-23)15(9-12)22-17(26)11-7-13(24(27)28)10-14(8-11)25(29)30/h1-2,7-10H,3-6H2,(H,22,26)