4-[[4-[4-chloranyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[4-chloranyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[[4-chloro-3-(2-oxo-1-pyrrolidinyl)phenyl]-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[4-chloro-3-(2-ketopyrrolidino)benzoyl]piperazino]methyl]benzonitrile Formula: C23H23ClN4O2 MolecularWeight: 422.90732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N)Cl

Isomeric SMILES

C1CC(=O)N(C1)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N)Cl

InChI

InChI=1S/C23H23ClN4O2/c24-20-8-7-19(14-21(20)28-9-1-2-22(28)29)23(30)27-12-10-26(11-13-27)16-18-5-3-17(15-25)4-6-18/h3-8,14H,1-2,9-13,16H2