3-[[(2-bromanyl-4-nitro-phenyl)amino]methyl]benzenecarbonitrile

Systemtic Name: 3-[[(2-bromanyl-4-nitro-phenyl)amino]methyl]benzenecarbonitrile Openeye Name: 3-[(2-bromo-4-nitro-anilino)methyl]benzonitrile CAS Name: 3-[(2-bromo-4-nitroanilino)methyl]benzonitrile IUPAC Name: 3-[(2-bromo-4-nitroanilino)methyl]benzonitrile Traditional Name: 3-[(2-bromo-4-nitro-anilino)methyl]benzonitrile Formula: C14H10BrN3O2 MolecularWeight: 332.1521

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])Br)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])Br)C#N

InChI

InChI=1S/C14H10BrN3O2/c15-13-7-12(18(19)20)4-5-14(13)17-9-11-3-1-2-10(6-11)8-16/h1-7,17H,9H2