N,N-diethyl-4-[2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: N,N-diethyl-4-[2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: N,N-diethyl-4-[[2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N,N-diethyl-4-[[2-[4-(4-fluorophenyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: N,N-diethyl-4-[[2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: N,N-diethyl-4-[[2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C23H30FN4O2+ MolecularWeight: 413.508303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29FN4O2/c1-3-27(4-2)23(30)18-5-9-20(10-6-18)25-22(29)17-26-13-15-28(16-14-26)21-11-7-19(24)8-12-21/h5-12H,3-4,13-17H2,1-2H3,(H,25,29)/p+1