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

Systemtic Name: 2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylamino]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-6-fluoro-benzonitrile CAS Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-6-fluorobenzonitrile IUPAC Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-6-fluorobenzonitrile Traditional Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-6-fluoro-benzonitrile Formula: C15H10BrFN2O2 MolecularWeight: 349.154503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10BrFN2O2/c16-11-5-15-14(20-8-21-15)4-9(11)7-19-13-3-1-2-12(17)10(13)6-18/h1-5,19H,7-8H2