4-(2,5-dimethylpiperazin-1-yl)-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-(2,5-dimethylpiperazin-1-yl)-2-fluoranyl-benzenecarbonitrile Openeye Name: 4-(2,5-dimethylpiperazin-1-yl)-2-fluoro-benzonitrile CAS Name: 4-(2,5-dimethyl-1-piperazinyl)-2-fluorobenzonitrile IUPAC Name: 4-(2,5-dimethylpiperazin-1-yl)-2-fluorobenzonitrile Traditional Name: 4-(2,5-dimethylpiperazino)-2-fluoro-benzonitrile Formula: C13H16FN3 MolecularWeight: 233.284643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CNC(CN1C2=CC(=C(C=C2)C#N)F)C

Isomeric SMILES

CC1CNC(CN1C2=CC(=C(C=C2)C#N)F)C

InChI

InChI=1S/C13H16FN3/c1-9-8-17(10(2)7-16-9)12-4-3-11(6-15)13(14)5-12/h3-5,9-10,16H,7-8H2,1-2H3