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

Systemtic Name: N-[(3-fluorophenyl)methyl]-N-methyl-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(3-fluorophenyl)methyl]-N-methyl-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(3-fluorophenyl)methyl]-N-methyl-2-[4-(4-nitrophenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(3-fluorophenyl)methyl]-N-methyl-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(3-fluorobenzyl)-N-methyl-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]acetamide Formula: C20H24FN4O3+ MolecularWeight: 387.427963

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23FN4O3/c1-22(14-16-3-2-4-17(21)13-16)20(26)15-23-9-11-24(12-10-23)18-5-7-19(8-6-18)25(27)28/h2-8,13H,9-12,14-15H2,1H3/p+1