3-bromanyl-4-[(7-chloranyl-1,3-benzodioxol-5-yl)methylamino]benzenecarbonitrile

Systemtic Name: 3-bromanyl-4-[(7-chloranyl-1,3-benzodioxol-5-yl)methylamino]benzenecarbonitrile Openeye Name: 3-bromo-4-[(7-chloro-1,3-benzodioxol-5-yl)methylamino]benzonitrile CAS Name: 3-bromo-4-[(7-chloro-1,3-benzodioxol-5-yl)methylamino]benzonitrile IUPAC Name: 3-bromo-4-[(7-chloro-1,3-benzodioxol-5-yl)methylamino]benzonitrile Traditional Name: 3-bromo-4-[(7-chloro-1,3-benzodioxol-5-yl)methylamino]benzonitrile Formula: C15H10BrClN2O2 MolecularWeight: 365.6091

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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