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

Systemtic Name: 3-[[3,5-bis(bromanyl)-4-ethoxy-phenyl]methylamino]benzenecarbonitrile Openeye Name: 3-[(3,5-dibromo-4-ethoxy-phenyl)methylamino]benzonitrile CAS Name: 3-[(3,5-dibromo-4-ethoxyphenyl)methylamino]benzonitrile IUPAC Name: 3-[(3,5-dibromo-4-ethoxyphenyl)methylamino]benzonitrile Traditional Name: 3-[(3,5-dibromo-4-ethoxy-benzyl)amino]benzonitrile Formula: C16H14Br2N2O MolecularWeight: 410.10316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)CNC2=CC=CC(=C2)C#N)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)CNC2=CC=CC(=C2)C#N)Br

InChI

InChI=1S/C16H14Br2N2O/c1-2-21-16-14(17)7-12(8-15(16)18)10-20-13-5-3-4-11(6-13)9-19/h3-8,20H,2,10H2,1H3