2-[4-[2-(4-fluorophenyl)carbonylphenyl]carbonylpiperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-[2-(4-fluorophenyl)carbonylphenyl]carbonylpiperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-[2-(4-fluorobenzoyl)benzoyl]piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide CAS Name: 2-[4-[[2-[(4-fluorophenyl)-oxomethyl]phenyl]-oxomethyl]-1-piperazin-1-iumyl]-N,N-dimethylacetamide IUPAC Name: 2-[4-[2-(4-fluorobenzoyl)benzoyl]piperazin-1-ium-1-yl]-N,N-dimethylacetamide Traditional Name: 2-[4-[2-(4-fluorobenzoyl)benzoyl]piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide Formula: C22H25FN3O3+ MolecularWeight: 398.450603

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(C)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H24FN3O3/c1-24(2)20(27)15-25-11-13-26(14-12-25)22(29)19-6-4-3-5-18(19)21(28)16-7-9-17(23)10-8-16/h3-10H,11-15H2,1-2H3/p+1