2-[(2R)-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-cyclopentyl-ethanamide

Systemtic Name: 2-[(2R)-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-cyclopentyl-ethanamide Openeye Name: 2-[(2R)-1-[(2-chloro-6-fluoro-phenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-cyclopentyl-acetamide CAS Name: 2-[(2R)-1-[(2-chloro-6-fluorophenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-cyclopentylacetamide IUPAC Name: 2-[(2R)-1-[(2-chloro-6-fluorophenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-cyclopentylacetamide Traditional Name: 2-[(2R)-1-(2-chloro-6-fluoro-benzyl)-3-keto-piperazin-1-ium-2-yl]-N-cyclopentyl-acetamide Formula: C18H24ClFN3O2+ MolecularWeight: 368.853463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)CC2C(=O)NCC[NH+]2CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CCC(C1)NC(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C18H23ClFN3O2/c19-14-6-3-7-15(20)13(14)11-23-9-8-21-18(25)16(23)10-17(24)22-12-4-1-2-5-12/h3,6-7,12,16H,1-2,4-5,8-11H2,(H,21,25)(H,22,24)/p+1/t16-/m1/s1