3-pyrrolidin-1-ium-1-ylpropyl 2-oxidanyl-2,2-diphenyl-ethanoate chloride

Systemtic Name: 3-pyrrolidin-1-ium-1-ylpropyl 2-oxidanyl-2,2-diphenyl-ethanoate chloride Openeye Name: 3-pyrrolidin-1-ium-1-ylpropyl 2-hydroxy-2,2-diphenyl-acetate chloride CAS Name: 2-hydroxy-2,2-diphenylacetic acid 3-(1-pyrrolidin-1-iumyl)propyl ester chloride IUPAC Name: 3-pyrrolidin-1-ium-1-ylpropyl 2-hydroxy-2,2-diphenylacetate chloride Traditional Name: 2-hydroxy-2,2-diphenyl-acetic acid 3-pyrrolidin-1-ium-1-ylpropyl ester chloride Formula: C21H26ClNO3 MolecularWeight: 375.88904

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCCOC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O.[Cl-]

Isomeric SMILES

C1CC[NH+](C1)CCCOC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O.[Cl-]

InChI

InChI=1S/C21H25NO3.ClH/c23-20(25-17-9-16-22-14-7-8-15-22)21(24,18-10-3-1-4-11-18)19-12-5-2-6-13-19;/h1-6,10-13,24H,7-9,14-17H2;1H