2-fluoranyl-N-[2-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]benzamide

Systemtic Name: 2-fluoranyl-N-[2-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]benzamide Openeye Name: N-[2-(4-benzylpiperazin-4-ium-1-carbonyl)phenyl]-2-fluoro-benzamide CAS Name: 2-fluoro-N-[2-[oxo-[4-(phenylmethyl)-1-piperazin-4-iumyl]methyl]phenyl]benzamide IUPAC Name: N-[2-(4-benzylpiperazin-4-ium-1-carbonyl)phenyl]-2-fluorobenzamide Traditional Name: N-[2-(4-benzylpiperazin-4-ium-1-carbonyl)phenyl]-2-fluoro-benzamide Formula: C25H25FN3O2+ MolecularWeight: 418.483303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC=CC=C3NC(=O)C4=CC=CC=C4F

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC=CC=C3NC(=O)C4=CC=CC=C4F

InChI

InChI=1S/C25H24FN3O2/c26-22-12-6-4-10-20(22)24(30)27-23-13-7-5-11-21(23)25(31)29-16-14-28(15-17-29)18-19-8-2-1-3-9-19/h1-13H,14-18H2,(H,27,30)/p+1