4-[(7-bromanyl-1,3-benzodioxol-5-yl)methylamino]-2-chloranyl-benzenecarbonitrile

Systemtic Name: 4-[(7-bromanyl-1,3-benzodioxol-5-yl)methylamino]-2-chloranyl-benzenecarbonitrile Openeye Name: 4-[(7-bromo-1,3-benzodioxol-5-yl)methylamino]-2-chloro-benzonitrile CAS Name: 4-[(7-bromo-1,3-benzodioxol-5-yl)methylamino]-2-chlorobenzonitrile IUPAC Name: 4-[(7-bromo-1,3-benzodioxol-5-yl)methylamino]-2-chlorobenzonitrile Traditional Name: 4-[(7-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(=CC(=C2)CNC3=CC(=C(C=C3)C#N)Cl)Br

Isomeric SMILES

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

InChI

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