N-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-4-nitro-aniline

Systemtic Name: N-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-4-nitro-aniline Openeye Name: N-[(3-bromo-4-fluoro-phenyl)methyl]-4-nitro-aniline CAS Name: N-[(3-bromo-4-fluorophenyl)methyl]-4-nitroaniline IUPAC Name: N-[(3-bromo-4-fluorophenyl)methyl]-4-nitroaniline Traditional Name: (3-bromo-4-fluoro-benzyl)-(4-nitrophenyl)amine Formula: C13H10BrFN2O2 MolecularWeight: 325.133103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCC2=CC(=C(C=C2)F)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NCC2=CC(=C(C=C2)F)Br)[N+](=O)[O-]

InChI

InChI=1S/C13H10BrFN2O2/c14-12-7-9(1-6-13(12)15)8-16-10-2-4-11(5-3-10)17(18)19/h1-7,16H,8H2