(2R,4S)-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonyl]-4-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: (2R,4S)-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonyl]-4-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: (2R,4S)-1-[(3S)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]-4-hydroxy-pyrrolidine-2-carboxylate CAS Name: (2R,4S)-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-oxomethyl]-4-hydroxy-2-pyrrolidinecarboxylate IUPAC Name: (2R,4S)-1-[(3S)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]-4-hydroxypyrrolidine-2-carboxylate Traditional Name: (2R,4S)-1-[(3S)-2,3-dihydro-1,4-benzodioxin-3-carbonyl]-4-hydroxy-pyrrolidine-2-carboxylate Formula: C14H14NO6- MolecularWeight: 292.26406

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)[O-])C(=O)C2COC3=CC=CC=C3O2)O

Isomeric SMILES

C1[C@@H](CN([C@H]1C(=O)[O-])C(=O)[C@@H]2COC3=CC=CC=C3O2)O

InChI

InChI=1S/C14H15NO6/c16-8-5-9(14(18)19)15(6-8)13(17)12-7-20-10-3-1-2-4-11(10)21-12/h1-4,8-9,12,16H,5-7H2,(H,18,19)/p-1/t8-,9+,12-/m0/s1