(2S,4R)-1-(9H-fluoren-9-ylmethoxycarbonyl)-4-sulfooxy-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4R)-1-(9H-fluoren-9-ylmethoxycarbonyl)-4-sulfooxy-pyrrolidine-2-carboxylic acid Openeye Name: (2S,4R)-1-(9H-fluoren-9-ylmethoxycarbonyl)-4-sulfooxy-pyrrolidine-2-carboxylic acid CAS Name: (2S,4R)-1-[9H-fluoren-9-ylmethoxy(oxo)methyl]-4-sulfooxy-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4R)-1-(9H-fluoren-9-ylmethoxycarbonyl)-4-sulfooxypyrrolidine-2-carboxylic acid Traditional Name: (2S,4R)-1-(9H-fluoren-9-ylmethoxycarbonyl)-4-sulfoxy-proline Formula: C20H19NO8S MolecularWeight: 433.43176

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)O)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)OS(=O)(=O)O

Isomeric SMILES

C1[C@H](CN([C@@H]1C(=O)O)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)OS(=O)(=O)O

InChI

InChI=1S/C20H19NO8S/c22-19(23)18-9-12(29-30(25,26)27)10-21(18)20(24)28-11-17-15-7-3-1-5-13(15)14-6-2-4-8-16(14)17/h1-8,12,17-18H,9-11H2,(H,22,23)(H,25,26,27)/t12-,18+/m1/s1