(2S,3R)-4-ethyl-2-phenyl-morpholin-4-ium-3-carboxylic acid

Systemtic Name: (2S,3R)-4-ethyl-2-phenyl-morpholin-4-ium-3-carboxylic acid Openeye Name: (2S,3R)-4-ethyl-2-phenyl-morpholin-4-ium-3-carboxylic acid CAS Name: (2S,3R)-4-ethyl-2-phenyl-3-morpholin-4-iumcarboxylic acid IUPAC Name: (2S,3R)-4-ethyl-2-phenylmorpholin-4-ium-3-carboxylic acid Traditional Name: (2S,3R)-4-ethyl-2-phenyl-morpholin-4-ium-3-carboxylic acid Formula: C13H18NO3+ MolecularWeight: 236.28692

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCOC(C1C(=O)O)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO3/c1-2-14-8-9-17-12(11(14)13(15)16)10-6-4-3-5-7-10/h3-7,11-12H,2,8-9H2,1H3,(H,15,16)/p+1/t11-,12+/m1/s1