(2R,3R)-3-oxidanyl-3-phenyl-2-pyridin-1-ium-1-yl-propanoate

Systemtic Name: (2R,3R)-3-oxidanyl-3-phenyl-2-pyridin-1-ium-1-yl-propanoate Openeye Name: (2R,3R)-3-hydroxy-3-phenyl-2-pyridin-1-ium-1-yl-propanoate CAS Name: (2R,3R)-3-hydroxy-3-phenyl-2-(1-pyridin-1-iumyl)propanoate IUPAC Name: (2R,3R)-3-hydroxy-3-phenyl-2-pyridin-1-ium-1-ylpropanoate Traditional Name: (2R,3R)-3-hydroxy-3-phenyl-2-pyridin-1-ium-1-yl-propionate Formula: C14H13NO3 MolecularWeight: 243.25792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(=O)[O-])[N+]2=CC=CC=C2)O

Isomeric SMILES

C1=CC=C(C=C1)[C@H]([C@H](C(=O)[O-])[N+]2=CC=CC=C2)O

InChI

InChI=1S/C14H13NO3/c16-13(11-7-3-1-4-8-11)12(14(17)18)15-9-5-2-6-10-15/h1-10,12-13,16H/t12-,13-/m1/s1