4-[[bis(cyanomethyl)amino]methyl]-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[[bis(cyanomethyl)amino]methyl]-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-[[bis(cyanomethyl)amino]methyl]-3-fluoro-benzonitrile CAS Name: 4-[[bis(cyanomethyl)amino]methyl]-3-fluorobenzonitrile IUPAC Name: 4-[[bis(cyanomethyl)amino]methyl]-3-fluorobenzonitrile Traditional Name: 4-[[bis(cyanomethyl)amino]methyl]-3-fluoro-benzonitrile Formula: C12H9FN4 MolecularWeight: 228.225063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)F)CN(CC#N)CC#N

Isomeric SMILES

C1=CC(=C(C=C1C#N)F)CN(CC#N)CC#N

InChI

InChI=1S/C12H9FN4/c13-12-7-10(8-16)1-2-11(12)9-17(5-3-14)6-4-15/h1-2,7H,5-6,9H2