2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-N-ethyl-N-[(3-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-N-ethyl-N-[(3-fluorophenyl)methyl]ethanamide Openeye Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-ethyl-N-[(3-fluorophenyl)methyl]acetamide CAS Name: 2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]-N-ethyl-N-[(3-fluorophenyl)methyl]acetamide IUPAC Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-ethyl-N-[(3-fluorophenyl)methyl]acetamide Traditional Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-ethyl-N-(3-fluorobenzyl)acetamide Formula: C23H29FN3O2+ MolecularWeight: 398.493663

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=CC=C1)F)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCN(CC1=CC(=CC=C1)F)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C23H28FN3O2/c1-3-26(16-19-5-4-6-21(24)15-19)23(29)17-25-11-13-27(14-12-25)22-9-7-20(8-10-22)18(2)28/h4-10,15H,3,11-14,16-17H2,1-2H3/p+1