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

Systemtic Name: 4-[[3,5-bis(bromanyl)-4-methoxy-phenyl]methylamino]-3-bromanyl-benzenecarbonitrile Openeye Name: 3-bromo-4-[(3,5-dibromo-4-methoxy-phenyl)methylamino]benzonitrile CAS Name: 3-bromo-4-[(3,5-dibromo-4-methoxyphenyl)methylamino]benzonitrile IUPAC Name: 3-bromo-4-[(3,5-dibromo-4-methoxyphenyl)methylamino]benzonitrile Traditional Name: 3-bromo-4-[(3,5-dibromo-4-methoxy-benzyl)amino]benzonitrile Formula: C15H11Br3N2O MolecularWeight: 474.97264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Br)CNC2=C(C=C(C=C2)C#N)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1Br)CNC2=C(C=C(C=C2)C#N)Br)Br

InChI

InChI=1S/C15H11Br3N2O/c1-21-15-12(17)5-10(6-13(15)18)8-20-14-3-2-9(7-19)4-11(14)16/h2-6,20H,8H2,1H3