3-[[(2S,4S)-4-oxidanylpyrrolidin-2-yl]carbonylamino]benzoic acid

Systemtic Name: 3-[[(2S,4S)-4-oxidanylpyrrolidin-2-yl]carbonylamino]benzoic acid Openeye Name: 3-[[(2S,4S)-4-hydroxypyrrolidine-2-carbonyl]amino]benzoic acid CAS Name: 3-[[[(2S,4S)-4-hydroxy-2-pyrrolidinyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[(2S,4S)-4-hydroxypyrrolidine-2-carbonyl]amino]benzoic acid Traditional Name: 3-[[(2S,4S)-4-hydroxyprolyl]amino]benzoic acid Formula: C12H14N2O4 MolecularWeight: 250.25056

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC1C(=O)NC2=CC=CC(=C2)C(=O)O)O

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O4/c15-9-5-10(13-6-9)11(16)14-8-3-1-2-7(4-8)12(17)18/h1-4,9-10,13,15H,5-6H2,(H,14,16)(H,17,18)/t9-,10-/m0/s1