2-fluoranyl-N-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]benzamide

Systemtic Name: 2-fluoranyl-N-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]benzamide Openeye Name: 2-fluoro-N-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]benzamide CAS Name: 2-fluoro-N-[3-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]propyl]benzamide IUPAC Name: 2-fluoro-N-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]benzamide Traditional Name: 2-fluoro-N-[3-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]propyl]benzamide Formula: C21H27FN3O2+ MolecularWeight: 372.456383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC[NH+](CC2)CCCNC(=O)C3=CC=CC=C3F

Isomeric SMILES

COC1=CC=C(C=C1)N2CC[NH+](CC2)CCCNC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H26FN3O2/c1-27-18-9-7-17(8-10-18)25-15-13-24(14-16-25)12-4-11-23-21(26)19-5-2-3-6-20(19)22/h2-3,5-10H,4,11-16H2,1H3,(H,23,26)/p+1