3-[2,4-bis(chloranyl)phenoxy]-N,N-diethyl-2,6-dinitro-4-(trifluoromethyl)aniline

Systemtic Name: 3-[2,4-bis(chloranyl)phenoxy]-N,N-diethyl-2,6-dinitro-4-(trifluoromethyl)aniline Openeye Name: 3-(2,4-dichlorophenoxy)-N,N-diethyl-2,6-dinitro-4-(trifluoromethyl)aniline CAS Name: 3-(2,4-dichlorophenoxy)-N,N-diethyl-2,6-dinitro-4-(trifluoromethyl)aniline IUPAC Name: 3-(2,4-dichlorophenoxy)-N,N-diethyl-2,6-dinitro-4-(trifluoromethyl)aniline Traditional Name: [3-(2,4-dichlorophenoxy)-2,6-dinitro-4-(trifluoromethyl)phenyl]-diethyl-amine Formula: C17H14Cl2F3N3O5 MolecularWeight: 468.21137

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C(=C1[N+](=O)[O-])OC2=C(C=C(C=C2)Cl)Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=C(C=C(C(=C1[N+](=O)[O-])OC2=C(C=C(C=C2)Cl)Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H14Cl2F3N3O5/c1-3-23(4-2)14-12(24(26)27)8-10(17(20,21)22)16(15(14)25(28)29)30-13-6-5-9(18)7-11(13)19/h5-8H,3-4H2,1-2H3