2-[(2R)-1-[(2-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(2-pyrazol-1-ylethyl)ethanamide

Systemtic Name: 2-[(2R)-1-[(2-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(2-pyrazol-1-ylethyl)ethanamide Openeye Name: 2-[(2R)-1-[(2-fluorophenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-(2-pyrazol-1-ylethyl)acetamide CAS Name: 2-[(2R)-1-[(2-fluorophenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-[2-(1-pyrazolyl)ethyl]acetamide IUPAC Name: 2-[(2R)-1-[(2-fluorophenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-(2-pyrazol-1-ylethyl)acetamide Traditional Name: 2-[(2R)-1-(2-fluorobenzyl)-3-keto-piperazin-1-ium-2-yl]-N-(2-pyrazol-1-ylethyl)acetamide Formula: C18H23FN5O2+ MolecularWeight: 360.405923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)NCCN2C=CC=N2)CC3=CC=CC=C3F

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)NCCN2C=CC=N2)CC3=CC=CC=C3F

InChI

InChI=1S/C18H22FN5O2/c19-15-5-2-1-4-14(15)13-23-10-7-21-18(26)16(23)12-17(25)20-8-11-24-9-3-6-22-24/h1-6,9,16H,7-8,10-13H2,(H,20,25)(H,21,26)/p+1/t16-/m1/s1