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

Systemtic Name: (2R)-N-(4-fluorophenyl)-2-phenyl-2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: (2R)-2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-(4-fluorophenyl)-2-phenyl-acetamide CAS Name: (2R)-2-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]-N-(4-fluorophenyl)-2-phenylacetamide IUPAC Name: (2R)-2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]-N-(4-fluorophenyl)-2-phenylacetamide Traditional Name: (2R)-2-(4-besylpiperazin-1-ium-1-yl)-N-(4-fluorophenyl)-2-phenyl-acetamide Formula: C24H25FN3O3S+ MolecularWeight: 454.537003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1[C@H](C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H24FN3O3S/c25-20-11-13-21(14-12-20)26-24(29)23(19-7-3-1-4-8-19)27-15-17-28(18-16-27)32(30,31)22-9-5-2-6-10-22/h1-14,23H,15-18H2,(H,26,29)/p+1/t23-/m1/s1