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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14F3N3O6/c1-3-5-25-12(20)17(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