3-bromanyl-4-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylamino]benzenecarbonitrile

Systemtic Name: 3-bromanyl-4-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylamino]benzenecarbonitrile Openeye Name: 3-bromo-4-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylamino]benzonitrile CAS Name: 3-bromo-4-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylamino]benzonitrile IUPAC Name: 3-bromo-4-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylamino]benzonitrile Traditional Name: 3-bromo-4-[(3-bromo-4-hydroxy-5-methoxy-benzyl)amino]benzonitrile Formula: C15H12Br2N2O2 MolecularWeight: 412.07598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC2=C(C=C(C=C2)C#N)Br)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC2=C(C=C(C=C2)C#N)Br)Br)O

InChI

InChI=1S/C15H12Br2N2O2/c1-21-14-6-10(5-12(17)15(14)20)8-19-13-3-2-9(7-18)4-11(13)16/h2-6,19-20H,8H2,1H3