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

Systemtic Name: ethyl N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propyl-carbamate Openeye Name: ethyl N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propyl-carbamate CAS Name: N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propylcarbamic acid ethyl ester IUPAC Name: ethyl N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propylcarbamate Traditional Name: N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propyl-carbamic acid ethyl ester Formula: C13H14F3N3O6 MolecularWeight: 365.26197

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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)OCC

Isomeric SMILES

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

InChI

InChI=1S/C13H14F3N3O6/c1-3-5-17(12(20)25-4-2)11-9(18(21)22)6-8(13(14,15)16)7-10(11)19(23)24/h6-7H,3-5H2,1-2H3