4-(1,4-diazepan-1-yl)-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-(1,4-diazepan-1-yl)-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-(1,4-diazepan-1-yl)-3-fluoro-benzonitrile CAS Name: 4-(1,4-diazepan-1-yl)-3-fluorobenzonitrile IUPAC Name: 4-(1,4-diazepan-1-yl)-3-fluorobenzonitrile Traditional Name: 4-(1,4-diazepan-1-yl)-3-fluoro-benzonitrile Formula: C12H14FN3 MolecularWeight: 219.258063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=C(C=C(C=C2)C#N)F

Isomeric SMILES

C1CNCCN(C1)C2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C12H14FN3/c13-11-8-10(9-14)2-3-12(11)16-6-1-4-15-5-7-16/h2-3,8,15H,1,4-7H2