2,4-bis(bromanyl)-N-[2,4-dinitro-6-(trifluoromethyl)phenyl]-3-methyl-N-propyl-aniline

Systemtic Name: 2,4-bis(bromanyl)-N-[2,4-dinitro-6-(trifluoromethyl)phenyl]-3-methyl-N-propyl-aniline Openeye Name: 2,4-dibromo-N-[2,4-dinitro-6-(trifluoromethyl)phenyl]-3-methyl-N-propyl-aniline CAS Name: 2,4-dibromo-N-[2,4-dinitro-6-(trifluoromethyl)phenyl]-3-methyl-N-propylaniline IUPAC Name: 2,4-dibromo-N-[2,4-dinitro-6-(trifluoromethyl)phenyl]-3-methyl-N-propylaniline Traditional Name: (2,4-dibromo-3-methyl-phenyl)-[2,4-dinitro-6-(trifluoromethyl)phenyl]-propyl-amine Formula: C17H14Br2F3N3O4 MolecularWeight: 541.11397

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14Br2F3N3O4/c1-3-6-23(13-5-4-12(18)9(2)15(13)19)16-11(17(20,21)22)7-10(24(26)27)8-14(16)25(28)29/h4-5,7-8H,3,6H2,1-2H3