2-[(2R)-1-[(4-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(quinolin-3-ylmethyl)ethanamide

Systemtic Name: 2-[(2R)-1-[(4-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(quinolin-3-ylmethyl)ethanamide Openeye Name: 2-[(2R)-1-[(4-fluorophenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-(3-quinolylmethyl)acetamide CAS Name: 2-[(2R)-1-[(4-fluorophenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-(3-quinolinylmethyl)acetamide IUPAC Name: 2-[(2R)-1-[(4-fluorophenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-(quinolin-3-ylmethyl)acetamide Traditional Name: 2-[(2R)-1-(4-fluorobenzyl)-3-keto-piperazin-1-ium-2-yl]-N-(3-quinolylmethyl)acetamide Formula: C23H24FN4O2+ MolecularWeight: 407.460663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)NCC2=CC3=CC=CC=C3N=C2)CC4=CC=C(C=C4)F

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)NCC2=CC3=CC=CC=C3N=C2)CC4=CC=C(C=C4)F

InChI

InChI=1S/C23H23FN4O2/c24-19-7-5-16(6-8-19)15-28-10-9-25-23(30)21(28)12-22(29)27-14-17-11-18-3-1-2-4-20(18)26-13-17/h1-8,11,13,21H,9-10,12,14-15H2,(H,25,30)(H,27,29)/p+1/t21-/m1/s1