3-nitro-N-[3-[propanoyl-[3-(trifluoromethyl)phenyl]amino]propyl]benzamide

Systemtic Name: 3-nitro-N-[3-[propanoyl-[3-(trifluoromethyl)phenyl]amino]propyl]benzamide Openeye Name: 3-nitro-N-[3-[N-propanoyl-3-(trifluoromethyl)anilino]propyl]benzamide CAS Name: 3-nitro-N-[3-[N-(1-oxopropyl)-3-(trifluoromethyl)anilino]propyl]benzamide IUPAC Name: 3-nitro-N-[3-[N-propanoyl-3-(trifluoromethyl)anilino]propyl]benzamide Traditional Name: 3-nitro-N-[3-[N-propionyl-3-(trifluoromethyl)anilino]propyl]benzamide Formula: C20H20F3N3O4 MolecularWeight: 423.38571

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CCCNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCC(=O)N(CCCNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C20H20F3N3O4/c1-2-18(27)25(16-8-4-7-15(13-16)20(21,22)23)11-5-10-24-19(28)14-6-3-9-17(12-14)26(29)30/h3-4,6-9,12-13H,2,5,10-11H2,1H3,(H,24,28)