N-(4-chloranyl-2-nitro-phenyl)-2,4-dinitro-N-propyl-6-(trifluoromethyl)aniline

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-2,4-dinitro-N-propyl-6-(trifluoromethyl)aniline Openeye Name: N-(4-chloro-2-nitro-phenyl)-2,4-dinitro-N-propyl-6-(trifluoromethyl)aniline CAS Name: N-(4-chloro-2-nitrophenyl)-2,4-dinitro-N-propyl-6-(trifluoromethyl)aniline IUPAC Name: N-(4-chloro-2-nitrophenyl)-2,4-dinitro-N-propyl-6-(trifluoromethyl)aniline Traditional Name: (4-chloro-2-nitro-phenyl)-[2,4-dinitro-6-(trifluoromethyl)phenyl]-propyl-amine Formula: C16H12ClF3N4O6 MolecularWeight: 448.73789

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=C(C=C(C=C1)Cl)[N+](=O)[O-])C2=C(C=C(C=C2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCN(C1=C(C=C(C=C1)Cl)[N+](=O)[O-])C2=C(C=C(C=C2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H12ClF3N4O6/c1-2-5-21(12-4-3-9(17)6-13(12)23(27)28)15-11(16(18,19)20)7-10(22(25)26)8-14(15)24(29)30/h3-4,6-8H,2,5H2,1H3