2-[(4-bromanyl-3-nitro-phenyl)methylamino]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[(4-bromanyl-3-nitro-phenyl)methylamino]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[(4-bromo-3-nitro-phenyl)methylamino]-6-fluoro-benzonitrile CAS Name: 2-[(4-bromo-3-nitrophenyl)methylamino]-6-fluorobenzonitrile IUPAC Name: 2-[(4-bromo-3-nitrophenyl)methylamino]-6-fluorobenzonitrile Traditional Name: 2-[(4-bromo-3-nitro-benzyl)amino]-6-fluoro-benzonitrile Formula: C14H9BrFN3O2 MolecularWeight: 350.142563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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