N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propyl-ethanamide

Systemtic Name: N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propyl-ethanamide Openeye Name: N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propyl-acetamide CAS Name: N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propylacetamide IUPAC Name: N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propylacetamide Traditional Name: N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propyl-acetamide Formula: C12H12F3N3O5 MolecularWeight: 335.23599

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCCN(C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C12H12F3N3O5/c1-3-4-16(7(2)19)11-9(17(20)21)5-8(12(13,14)15)6-10(11)18(22)23/h5-6H,3-4H2,1-2H3