2-[(4-bromanyl-2-fluoranyl-phenyl)methylamino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[(4-bromanyl-2-fluoranyl-phenyl)methylamino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[(4-bromo-2-fluoro-phenyl)methylamino]-5-nitro-benzonitrile CAS Name: 2-[(4-bromo-2-fluorophenyl)methylamino]-5-nitrobenzonitrile IUPAC Name: 2-[(4-bromo-2-fluorophenyl)methylamino]-5-nitrobenzonitrile Traditional Name: 2-[(4-bromo-2-fluoro-benzyl)amino]-5-nitro-benzonitrile Formula: C14H9BrFN3O2 MolecularWeight: 350.142563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9BrFN3O2/c15-11-2-1-9(13(16)6-11)8-18-14-4-3-12(19(20)21)5-10(14)7-17/h1-6,18H,8H2