trimethyl-[(2S)-2-oxidanyl-3-phenylmethoxy-propyl]azanium chloride

Systemtic Name: trimethyl-[(2S)-2-oxidanyl-3-phenylmethoxy-propyl]azanium chloride Openeye Name: [(2S)-3-benzyloxy-2-hydroxy-propyl]-trimethyl-ammonium chloride CAS Name: [(2S)-2-hydroxy-3-phenylmethoxypropyl]-trimethylammonium chloride IUPAC Name: [(2S)-2-hydroxy-3-phenylmethoxypropyl]-trimethylazanium chloride Traditional Name: [(2S)-3-benzoxy-2-hydroxy-propyl]-trimethyl-ammonium chloride Formula: C13H22ClNO2 MolecularWeight: 259.77228

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(COCC1=CC=CC=C1)O.[Cl-]

Isomeric SMILES

C[N+](C)(C)C[C@@H](COCC1=CC=CC=C1)O.[Cl-]

InChI

InChI=1S/C13H22NO2.ClH/c1-14(2,3)9-13(15)11-16-10-12-7-5-4-6-8-12;/h4-8,13,15H,9-11H2,1-3H3;1H/q+1;/p-1/t13-;/m0./s1