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

Systemtic Name: (2R)-2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-N-(4-fluorophenyl)-2-phenyl-ethanamide Openeye Name: (2R)-2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-(4-fluorophenyl)-2-phenyl-acetamide CAS Name: (2R)-2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]-N-(4-fluorophenyl)-2-phenylacetamide IUPAC Name: (2R)-2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-(4-fluorophenyl)-2-phenylacetamide Traditional Name: (2R)-2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-(4-fluorophenyl)-2-phenyl-acetamide Formula: C26H27FN3O2+ MolecularWeight: 432.509883

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)C(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)[C@H](C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C26H26FN3O2/c1-19(31)20-7-13-24(14-8-20)29-15-17-30(18-16-29)25(21-5-3-2-4-6-21)26(32)28-23-11-9-22(27)10-12-23/h2-14,25H,15-18H2,1H3,(H,28,32)/p+1/t25-/m1/s1