(2R)-2-[(2S)-2-methylmorpholin-4-ium-4-yl]-2-phenyl-ethanoate

Systemtic Name: (2R)-2-[(2S)-2-methylmorpholin-4-ium-4-yl]-2-phenyl-ethanoate Openeye Name: (2R)-2-[(2S)-2-methylmorpholin-4-ium-4-yl]-2-phenyl-acetate CAS Name: (2R)-2-[(2S)-2-methyl-4-morpholin-4-iumyl]-2-phenylacetate IUPAC Name: (2R)-2-[(2S)-2-methylmorpholin-4-ium-4-yl]-2-phenylacetate Traditional Name: (2R)-2-[(2S)-2-methylmorpholin-4-ium-4-yl]-2-phenyl-acetate Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CCO1)C(C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

C[C@H]1C[NH+](CCO1)[C@H](C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C13H17NO3/c1-10-9-14(7-8-17-10)12(13(15)16)11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3,(H,15,16)/t10-,12+/m0/s1