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

Systemtic Name: N-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-4-methyl-3-nitro-aniline Openeye Name: N-[(3-bromo-4-fluoro-phenyl)methyl]-4-methyl-3-nitro-aniline CAS Name: N-[(3-bromo-4-fluorophenyl)methyl]-4-methyl-3-nitroaniline IUPAC Name: N-[(3-bromo-4-fluorophenyl)methyl]-4-methyl-3-nitroaniline Traditional Name: (3-bromo-4-fluoro-benzyl)-(4-methyl-3-nitro-phenyl)amine Formula: C14H12BrFN2O2 MolecularWeight: 339.159683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC2=CC(=C(C=C2)F)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NCC2=CC(=C(C=C2)F)Br)[N+](=O)[O-]

InChI

InChI=1S/C14H12BrFN2O2/c1-9-2-4-11(7-14(9)18(19)20)17-8-10-3-5-13(16)12(15)6-10/h2-7,17H,8H2,1H3