2-[4-[(1S)-1-(4-fluorophenyl)ethyl]piperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-[(1S)-1-(4-fluorophenyl)ethyl]piperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-[(1S)-1-(4-fluorophenyl)ethyl]piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide CAS Name: 2-[4-[(1S)-1-(4-fluorophenyl)ethyl]-1-piperazin-1-iumyl]-N,N-dimethylacetamide IUPAC Name: 2-[4-[(1S)-1-(4-fluorophenyl)ethyl]piperazin-1-ium-1-yl]-N,N-dimethylacetamide Traditional Name: 2-[4-[(1S)-1-(4-fluorophenyl)ethyl]piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide Formula: C16H25FN3O+ MolecularWeight: 294.387603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)F)N2CC[NH+](CC2)CC(=O)N(C)C

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)F)N2CC[NH+](CC2)CC(=O)N(C)C

InChI

InChI=1S/C16H24FN3O/c1-13(14-4-6-15(17)7-5-14)20-10-8-19(9-11-20)12-16(21)18(2)3/h4-7,13H,8-12H2,1-3H3/p+1/t13-/m0/s1