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

Systemtic Name: 2-[(2R)-1-[(2-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-phenethyl-ethanamide Openeye Name: 2-[(2R)-1-[(2-fluorophenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-phenethyl-acetamide CAS Name: 2-[(2R)-1-[(2-fluorophenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-phenethylacetamide IUPAC Name: 2-[(2R)-1-[(2-fluorophenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-phenethylacetamide Traditional Name: 2-[(2R)-1-(2-fluorobenzyl)-3-keto-piperazin-1-ium-2-yl]-N-phenethyl-acetamide Formula: C21H25FN3O2+ MolecularWeight: 370.440503

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)NCCC2=CC=CC=C2)CC3=CC=CC=C3F

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)NCCC2=CC=CC=C2)CC3=CC=CC=C3F

InChI

InChI=1S/C21H24FN3O2/c22-18-9-5-4-8-17(18)15-25-13-12-24-21(27)19(25)14-20(26)23-11-10-16-6-2-1-3-7-16/h1-9,19H,10-15H2,(H,23,26)(H,24,27)/p+1/t19-/m1/s1