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

Systemtic Name: N-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-4-ethyl-3-nitro-aniline Openeye Name: N-[(3-bromo-4-fluoro-phenyl)methyl]-4-ethyl-3-nitro-aniline CAS Name: N-[(3-bromo-4-fluorophenyl)methyl]-4-ethyl-3-nitroaniline IUPAC Name: N-[(3-bromo-4-fluorophenyl)methyl]-4-ethyl-3-nitroaniline Traditional Name: (3-bromo-4-fluoro-benzyl)-(4-ethyl-3-nitro-phenyl)amine Formula: C15H14BrFN2O2 MolecularWeight: 353.186263

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NCC2=CC(=C(C=C2)F)Br)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)NCC2=CC(=C(C=C2)F)Br)[N+](=O)[O-]

InChI

InChI=1S/C15H14BrFN2O2/c1-2-11-4-5-12(8-15(11)19(20)21)18-9-10-3-6-14(17)13(16)7-10/h3-8,18H,2,9H2,1H3