4-hexyl-2,6-dinitro-N-[2,4,6-tris(chloranyl)phenyl]aniline

Systemtic Name: 4-hexyl-2,6-dinitro-N-[2,4,6-tris(chloranyl)phenyl]aniline Openeye Name: 4-hexyl-2,6-dinitro-N-(2,4,6-trichlorophenyl)aniline CAS Name: 4-hexyl-2,6-dinitro-N-(2,4,6-trichlorophenyl)aniline IUPAC Name: 4-hexyl-2,6-dinitro-N-(2,4,6-trichlorophenyl)aniline Traditional Name: (4-hexyl-2,6-dinitro-phenyl)-(2,4,6-trichlorophenyl)amine Formula: C18H18Cl3N3O4 MolecularWeight: 446.71222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C(C(=C1)[N+](=O)[O-])NC2=C(C=C(C=C2Cl)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCCCC1=CC(=C(C(=C1)[N+](=O)[O-])NC2=C(C=C(C=C2Cl)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H18Cl3N3O4/c1-2-3-4-5-6-11-7-15(23(25)26)18(16(8-11)24(27)28)22-17-13(20)9-12(19)10-14(17)21/h7-10,22H,2-6H2,1H3