2-(1,3-benzodioxol-4-ylmethylamino)-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-(1,3-benzodioxol-4-ylmethylamino)-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-(1,3-benzodioxol-4-ylmethylamino)-6-fluoro-benzonitrile CAS Name: 2-(1,3-benzodioxol-4-ylmethylamino)-6-fluorobenzonitrile IUPAC Name: 2-(1,3-benzodioxol-4-ylmethylamino)-6-fluorobenzonitrile Traditional Name: 2-(1,3-benzodioxol-4-ylmethylamino)-6-fluoro-benzonitrile Formula: C15H11FN2O2 MolecularWeight: 270.258443

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=CC=CC(=C2O1)CNC3=C(C(=CC=C3)F)C#N

Isomeric SMILES

C1OC2=CC=CC(=C2O1)CNC3=C(C(=CC=C3)F)C#N

InChI

InChI=1S/C15H11FN2O2/c16-12-4-2-5-13(11(12)7-17)18-8-10-3-1-6-14-15(10)20-9-19-14/h1-6,18H,8-9H2