1-[2-oxidanyl-3-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propyl]pyrrolidin-2-one chloride

Systemtic Name: 1-[2-oxidanyl-3-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propyl]pyrrolidin-2-one chloride Openeye Name: 1-[2-hydroxy-3-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propyl]pyrrolidin-2-one chloride CAS Name: 1-[2-hydroxy-3-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]propyl]-2-pyrrolidinone chloride IUPAC Name: 1-[2-hydroxy-3-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propyl]pyrrolidin-2-one chloride Traditional Name: 1-[2-hydroxy-3-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]propyl]-2-pyrrolidone chloride Formula: C15H24ClN5O2 MolecularWeight: 341.83636

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC(C[NH+]2CCN(CC2)C3=NC=CC=N3)O.[Cl-]

Isomeric SMILES

C1CC(=O)N(C1)CC(C[NH+]2CCN(CC2)C3=NC=CC=N3)O.[Cl-]

InChI

InChI=1S/C15H23N5O2.ClH/c21-13(12-20-6-1-3-14(20)22)11-18-7-9-19(10-8-18)15-16-4-2-5-17-15;/h2,4-5,13,21H,1,3,6-12H2;1H