4-[[(2S,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]amino]benzoate

Systemtic Name: 4-[[(2S,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]amino]benzoate Openeye Name: 4-[[(2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]amino]benzoate CAS Name: 4-[[(2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]amino]benzoate IUPAC Name: 4-[[(2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]amino]benzoate Traditional Name: 4-[[(2S,4S,5R)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]amino]benzoate Formula: C12H14NO5- MolecularWeight: 252.24326

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1NC2=CC=C(C=C2)C(=O)[O-])CO)O

Isomeric SMILES

C1[C@@H]([C@H](O[C@@H]1NC2=CC=C(C=C2)C(=O)[O-])CO)O

InChI

InChI=1S/C12H15NO5/c14-6-10-9(15)5-11(18-10)13-8-3-1-7(2-4-8)12(16)17/h1-4,9-11,13-15H,5-6H2,(H,16,17)/p-1/t9-,10+,11-/m0/s1