propan-2-yl (2S,3R)-3-(1-oxidanidylpyridin-1-ium-2-yl)-2,3-bis(oxidanyl)propanoate

Systemtic Name: propan-2-yl (2S,3R)-3-(1-oxidanidylpyridin-1-ium-2-yl)-2,3-bis(oxidanyl)propanoate Openeye Name: isopropyl (2S,3R)-2,3-dihydroxy-3-(1-oxidopyridin-1-ium-2-yl)propanoate CAS Name: (2S,3R)-2,3-dihydroxy-3-(1-oxido-2-pyridin-1-iumyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (2S,3R)-2,3-dihydroxy-3-(1-oxidopyridin-1-ium-2-yl)propanoate Traditional Name: (2S,3R)-2,3-dihydroxy-3-(1-oxidopyridin-1-ium-2-yl)propionic acid isopropyl ester Formula: C11H15NO5 MolecularWeight: 241.2405

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(C(C1=CC=CC=[N+]1[O-])O)O

Isomeric SMILES

CC(C)OC(=O)[C@H]([C@@H](C1=CC=CC=[N+]1[O-])O)O

InChI

InChI=1S/C11H15NO5/c1-7(2)17-11(15)10(14)9(13)8-5-3-4-6-12(8)16/h3-7,9-10,13-14H,1-2H3/t9-,10+/m1/s1