[(2S,5R)-5-(phenylmethoxymethyl)pyrrolidin-1-ium-2-yl]methanol chloride

Systemtic Name: [(2S,5R)-5-(phenylmethoxymethyl)pyrrolidin-1-ium-2-yl]methanol chloride Openeye Name: [(2S,5R)-5-(benzyloxymethyl)pyrrolidin-1-ium-2-yl]methanol chloride CAS Name: [(2S,5R)-5-(phenylmethoxymethyl)-2-pyrrolidin-1-iumyl]methanol chloride IUPAC Name: [(2S,5R)-5-(phenylmethoxymethyl)pyrrolidin-1-ium-2-yl]methanol chloride Traditional Name: [(2S,5R)-5-(benzoxymethyl)pyrrolidin-1-ium-2-yl]methanol chloride Formula: C13H20ClNO2 MolecularWeight: 257.7564

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1CO)COCC2=CC=CC=C2.[Cl-]

Isomeric SMILES

C1C[C@@H]([NH2+][C@@H]1CO)COCC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C13H19NO2.ClH/c15-8-12-6-7-13(14-12)10-16-9-11-4-2-1-3-5-11;/h1-5,12-15H,6-10H2;1H/t12-,13+;/m0./s1