N-(2-ethylphenyl)-2-[4-[3-(2-fluorophenyl)propanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[4-[3-(2-fluorophenyl)propanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[4-[3-(2-fluorophenyl)propanoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-ethylphenyl)-2-[4-[3-(2-fluorophenyl)-1-oxopropyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[4-[3-(2-fluorophenyl)propanoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-ethylphenyl)-2-[4-[3-(2-fluorophenyl)propanoyl]piperazin-1-ium-1-yl]acetamide Formula: C23H29FN3O2+ MolecularWeight: 398.493663

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)CCC3=CC=CC=C3F

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)CCC3=CC=CC=C3F

InChI

InChI=1S/C23H28FN3O2/c1-2-18-7-4-6-10-21(18)25-22(28)17-26-13-15-27(16-14-26)23(29)12-11-19-8-3-5-9-20(19)24/h3-10H,2,11-17H2,1H3,(H,25,28)/p+1