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

Systemtic Name: 4-methyl-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-3,5-dinitro-benzamide Openeye Name: 4-methyl-N-[2-morpholino-5-(trifluoromethyl)phenyl]-3,5-dinitro-benzamide CAS Name: 4-methyl-N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]-3,5-dinitrobenzamide IUPAC Name: 4-methyl-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-3,5-dinitrobenzamide Traditional Name: 4-methyl-N-[2-morpholino-5-(trifluoromethyl)phenyl]-3,5-dinitro-benzamide Formula: C19H17F3N4O6 MolecularWeight: 454.35669

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H17F3N4O6/c1-11-16(25(28)29)8-12(9-17(11)26(30)31)18(27)23-14-10-13(19(20,21)22)2-3-15(14)24-4-6-32-7-5-24/h2-3,8-10H,4-7H2,1H3,(H,23,27)