(2R)-2-oxidanyl-2-phenyl-ethanoate; (2S)-pyrrolidin-1-ium-2-carboxylic acid

Systemtic Name: (2R)-2-oxidanyl-2-phenyl-ethanoate; (2S)-pyrrolidin-1-ium-2-carboxylic acid Openeye Name: (2R)-2-hydroxy-2-phenyl-acetate; (2S)-pyrrolidin-1-ium-2-carboxylic acid CAS Name: (2R)-2-hydroxy-2-phenylacetate; (2S)-2-pyrrolidin-1-iumcarboxylic acid IUPAC Name: (2R)-2-hydroxy-2-phenylacetate; (2S)-pyrrolidin-1-ium-2-carboxylic acid Traditional Name: (2R)-2-hydroxy-2-phenyl-acetate; (2S)-pyrrolidin-1-ium-2-carboxylic acid Formula: C13H17NO5 MolecularWeight: 267.27778

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)C(=O)O.C1=CC=C(C=C1)C(C(=O)[O-])O

Isomeric SMILES

C1C[C@H]([NH2+]C1)C(=O)O.C1=CC=C(C=C1)[C@H](C(=O)[O-])O

InChI

InChI=1S/C8H8O3.C5H9NO2/c9-7(8(10)11)6-4-2-1-3-5-6;7-5(8)4-2-1-3-6-4/h1-5,7,9H,(H,10,11);4,6H,1-3H2,(H,7,8)/t7-;4-/m10/s1