(3R,5R)-5-oxidanyl-1-(phenylmethyl)piperidin-1-ium-3-carboxylic acid

Systemtic Name: (3R,5R)-5-oxidanyl-1-(phenylmethyl)piperidin-1-ium-3-carboxylic acid Openeye Name: (3R,5R)-1-benzyl-5-hydroxy-piperidin-1-ium-3-carboxylic acid CAS Name: (3R,5R)-5-hydroxy-1-(phenylmethyl)-3-piperidin-1-iumcarboxylic acid IUPAC Name: (3R,5R)-1-benzyl-5-hydroxypiperidin-1-ium-3-carboxylic acid Traditional Name: (3R,5R)-1-benzyl-5-hydroxy-piperidin-1-ium-3-carboxylic acid Formula: C13H18NO3+ MolecularWeight: 236.28692

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C[NH+](CC1O)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1[C@H](C[NH+](C[C@@H]1O)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C13H17NO3/c15-12-6-11(13(16)17)8-14(9-12)7-10-4-2-1-3-5-10/h1-5,11-12,15H,6-9H2,(H,16,17)/p+1/t11-,12-/m1/s1