2-[4-[(4-fluorophenyl)methyl]piperazin-1-ium-1-yl]-N-phenethyl-ethanamide

Systemtic Name: 2-[4-[(4-fluorophenyl)methyl]piperazin-1-ium-1-yl]-N-phenethyl-ethanamide Openeye Name: 2-[4-[(4-fluorophenyl)methyl]piperazin-1-ium-1-yl]-N-phenethyl-acetamide CAS Name: 2-[4-[(4-fluorophenyl)methyl]-1-piperazin-1-iumyl]-N-phenethylacetamide IUPAC Name: 2-[4-[(4-fluorophenyl)methyl]piperazin-1-ium-1-yl]-N-phenethylacetamide Traditional Name: 2-[4-(4-fluorobenzyl)piperazin-1-ium-1-yl]-N-phenethyl-acetamide Formula: C21H27FN3O+ MolecularWeight: 356.456983

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NCCC2=CC=CC=C2)CC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NCCC2=CC=CC=C2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H26FN3O/c22-20-8-6-19(7-9-20)16-24-12-14-25(15-13-24)17-21(26)23-11-10-18-4-2-1-3-5-18/h1-9H,10-17H2,(H,23,26)/p+1