N-(3-aminophenyl)-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-aminophenyl)-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(3-aminophenyl)-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(3-aminophenyl)-2-[4-(4-fluorophenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3-aminophenyl)-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(3-aminophenyl)-2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]acetamide Formula: C18H22FN4O+ MolecularWeight: 329.391883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=CC(=C2)N)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC(=C2)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H21FN4O/c19-14-4-6-17(7-5-14)23-10-8-22(9-11-23)13-18(24)21-16-3-1-2-15(20)12-16/h1-7,12H,8-11,13,20H2,(H,21,24)/p+1