N-[[2,4-bis(fluoranyl)-5-nitro-phenyl]methyl]-4-bromanyl-2-fluoranyl-aniline

Systemtic Name: N-[[2,4-bis(fluoranyl)-5-nitro-phenyl]methyl]-4-bromanyl-2-fluoranyl-aniline Openeye Name: 4-bromo-N-[(2,4-difluoro-5-nitro-phenyl)methyl]-2-fluoro-aniline CAS Name: 4-bromo-N-[(2,4-difluoro-5-nitrophenyl)methyl]-2-fluoroaniline IUPAC Name: 4-bromo-N-[(2,4-difluoro-5-nitrophenyl)methyl]-2-fluoroaniline Traditional Name: (4-bromo-2-fluoro-phenyl)-(2,4-difluoro-5-nitro-benzyl)amine Formula: C13H8BrF3N2O2 MolecularWeight: 361.11403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)F)NCC2=CC(=C(C=C2F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1Br)F)NCC2=CC(=C(C=C2F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H8BrF3N2O2/c14-8-1-2-12(10(16)4-8)18-6-7-3-13(19(20)21)11(17)5-9(7)15/h1-5,18H,6H2