5-[(6-bromanyl-1,3-benzodioxol-5-yl)methylamino]-2-chloranyl-benzenecarbonitrile

Systemtic Name: 5-[(6-bromanyl-1,3-benzodioxol-5-yl)methylamino]-2-chloranyl-benzenecarbonitrile Openeye Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-2-chloro-benzonitrile CAS Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-2-chlorobenzonitrile IUPAC Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-2-chlorobenzonitrile Traditional Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-2-chloro-benzonitrile Formula: C15H10BrClN2O2 MolecularWeight: 365.6091

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CNC3=CC(=C(C=C3)Cl)C#N)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CNC3=CC(=C(C=C3)Cl)C#N)Br

InChI

InChI=1S/C15H10BrClN2O2/c16-12-5-15-14(20-8-21-15)4-10(12)7-19-11-1-2-13(17)9(3-11)6-18/h1-5,19H,7-8H2