2-[[3,5-bis(bromanyl)-2-methoxy-phenyl]methylamino]-4-chloranyl-benzenecarbonitrile

Systemtic Name: 2-[[3,5-bis(bromanyl)-2-methoxy-phenyl]methylamino]-4-chloranyl-benzenecarbonitrile Openeye Name: 4-chloro-2-[(3,5-dibromo-2-methoxy-phenyl)methylamino]benzonitrile CAS Name: 4-chloro-2-[(3,5-dibromo-2-methoxyphenyl)methylamino]benzonitrile IUPAC Name: 4-chloro-2-[(3,5-dibromo-2-methoxyphenyl)methylamino]benzonitrile Traditional Name: 4-chloro-2-[(3,5-dibromo-2-methoxy-benzyl)amino]benzonitrile Formula: C15H11Br2ClN2O MolecularWeight: 430.52164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1CNC2=C(C=CC(=C2)Cl)C#N)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1CNC2=C(C=CC(=C2)Cl)C#N)Br)Br

InChI

InChI=1S/C15H11Br2ClN2O/c1-21-15-10(4-11(16)5-13(15)17)8-20-14-6-12(18)3-2-9(14)7-19/h2-6,20H,8H2,1H3