tert-butyl 4-[[6-(hydroxymethyl)-3-oxidanyl-4-oxidanylidene-pyran-2-yl]methyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[[6-(hydroxymethyl)-3-oxidanyl-4-oxidanylidene-pyran-2-yl]methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[[3-hydroxy-6-(hydroxymethyl)-4-oxo-pyran-2-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[3-hydroxy-6-(hydroxymethyl)-4-oxo-2-pyranyl]methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[3-hydroxy-6-(hydroxymethyl)-4-oxopyran-2-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[(3-hydroxy-4-keto-6-methylol-pyran-2-yl)methyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C16H24N2O6 MolecularWeight: 340.37156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC2=C(C(=O)C=C(O2)CO)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC2=C(C(=O)C=C(O2)CO)O

InChI

InChI=1S/C16H24N2O6/c1-16(2,3)24-15(22)18-6-4-17(5-7-18)9-13-14(21)12(20)8-11(10-19)23-13/h8,19,21H,4-7,9-10H2,1-3H3