N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-methyl-2,4-dinitro-aniline

Systemtic Name: N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-methyl-2,4-dinitro-aniline Openeye Name: N-[(2-chloro-6-fluoro-phenyl)methyl]-N-methyl-2,4-dinitro-aniline CAS Name: N-[(2-chloro-6-fluorophenyl)methyl]-N-methyl-2,4-dinitroaniline IUPAC Name: N-[(2-chloro-6-fluorophenyl)methyl]-N-methyl-2,4-dinitroaniline Traditional Name: (2-chloro-6-fluoro-benzyl)-(2,4-dinitrophenyl)-methyl-amine Formula: C14H11ClFN3O4 MolecularWeight: 339.706243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC=C1Cl)F)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN(CC1=C(C=CC=C1Cl)F)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H11ClFN3O4/c1-17(8-10-11(15)3-2-4-12(10)16)13-6-5-9(18(20)21)7-14(13)19(22)23/h2-7H,8H2,1H3