(3R,4R,5S)-5-methoxycarbonyl-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxidanyl-piperidine-3-carboxylic acid

Systemtic Name: (3R,4R,5S)-5-methoxycarbonyl-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxidanyl-piperidine-3-carboxylic acid Openeye Name: (3R,4R,5S)-1-tert-butoxycarbonyl-4-hydroxy-5-methoxycarbonyl-piperidine-3-carboxylic acid CAS Name: (3R,4R,5S)-4-hydroxy-5-methoxycarbonyl-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: (3R,4R,5S)-4-hydroxy-5-methoxycarbonyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid Traditional Name: (3R,4R,5S)-1-tert-butoxycarbonyl-5-carbomethoxy-4-hydroxy-nipecotic acid Formula: C13H21NO7 MolecularWeight: 303.30834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(C(C(C1)C(=O)OC)O)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@H]([C@H]([C@H](C1)C(=O)OC)O)C(=O)O

InChI

InChI=1S/C13H21NO7/c1-13(2,3)21-12(19)14-5-7(10(16)17)9(15)8(6-14)11(18)20-4/h7-9,15H,5-6H2,1-4H3,(H,16,17)/t7-,8+,9-/m1/s1