(2R)-N-(4-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-phenyl-ethanamide

Systemtic Name: (2R)-N-(4-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-phenyl-ethanamide Openeye Name: (2R)-N-(4-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-phenyl-acetamide CAS Name: (2R)-N-(4-fluorophenyl)-2-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-2-phenylacetamide IUPAC Name: (2R)-N-(4-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-phenylacetamide Traditional Name: (2R)-N-(4-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-phenyl-acetamide Formula: C25H27FN3O2+ MolecularWeight: 420.499183

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)C(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)[C@H](C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C25H26FN3O2/c1-31-23-10-6-5-9-22(23)28-15-17-29(18-16-28)24(19-7-3-2-4-8-19)25(30)27-21-13-11-20(26)12-14-21/h2-14,24H,15-18H2,1H3,(H,27,30)/p+1/t24-/m1/s1