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

Systemtic Name: 1-[3-[4-(diphenylmethyl)piperazin-1-ium-1-yl]-2-oxidanyl-propyl]pyrrolidin-2-one chloride Openeye Name: 1-[3-(4-benzhydrylpiperazin-1-ium-1-yl)-2-hydroxy-propyl]pyrrolidin-2-one chloride CAS Name: 1-[3-[4-(diphenylmethyl)-1-piperazin-1-iumyl]-2-hydroxypropyl]-2-pyrrolidinone chloride IUPAC Name: 1-[3-(4-benzhydrylpiperazin-1-ium-1-yl)-2-hydroxypropyl]pyrrolidin-2-one chloride Traditional Name: 1-[3-(4-benzhydrylpiperazin-1-ium-1-yl)-2-hydroxy-propyl]-2-pyrrolidone chloride Formula: C24H32ClN3O2 MolecularWeight: 429.98278

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC(C[NH+]2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)O.[Cl-]

Isomeric SMILES

C1CC(=O)N(C1)CC(C[NH+]2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)O.[Cl-]

InChI

InChI=1S/C24H31N3O2.ClH/c28-22(19-27-13-7-12-23(27)29)18-25-14-16-26(17-15-25)24(20-8-3-1-4-9-20)21-10-5-2-6-11-21;/h1-6,8-11,22,24,28H,7,12-19H2;1H