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

Systemtic Name: 2-[(2R)-1-[(4-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(3-imidazol-1-ylpropyl)ethanamide Openeye Name: 2-[(2R)-1-[(4-fluorophenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-(3-imidazol-1-ylpropyl)acetamide CAS Name: 2-[(2R)-1-[(4-fluorophenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-[3-(1-imidazolyl)propyl]acetamide IUPAC Name: 2-[(2R)-1-[(4-fluorophenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-(3-imidazol-1-ylpropyl)acetamide Traditional Name: 2-[(2R)-1-(4-fluorobenzyl)-3-keto-piperazin-1-ium-2-yl]-N-(3-imidazol-1-ylpropyl)acetamide Formula: C19H25FN5O2+ MolecularWeight: 374.432503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)NCCCN2C=CN=C2)CC3=CC=C(C=C3)F

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)NCCCN2C=CN=C2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C19H24FN5O2/c20-16-4-2-15(3-5-16)13-25-11-8-23-19(27)17(25)12-18(26)22-6-1-9-24-10-7-21-14-24/h2-5,7,10,14,17H,1,6,8-9,11-13H2,(H,22,26)(H,23,27)/p+1/t17-/m1/s1