3-bromanyl-4-[(3-nitrophenyl)methylamino]benzenecarbonitrile

Systemtic Name: 3-bromanyl-4-[(3-nitrophenyl)methylamino]benzenecarbonitrile Openeye Name: 3-bromo-4-[(3-nitrophenyl)methylamino]benzonitrile CAS Name: 3-bromo-4-[(3-nitrophenyl)methylamino]benzonitrile IUPAC Name: 3-bromo-4-[(3-nitrophenyl)methylamino]benzonitrile Traditional Name: 3-bromo-4-[(3-nitrobenzyl)amino]benzonitrile Formula: C14H10BrN3O2 MolecularWeight: 332.1521

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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