2-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]-6-(hydroxymethyl)-3-oxidanyl-pyran-4-one

Systemtic Name: 2-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]-6-(hydroxymethyl)-3-oxidanyl-pyran-4-one Openeye Name: 3-hydroxy-2-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]-6-(hydroxymethyl)pyran-4-one CAS Name: 3-hydroxy-2-[[4-(2-hydroxyethyl)-1-piperazine-1,4-diiumyl]methyl]-6-(hydroxymethyl)-4-pyranone IUPAC Name: 3-hydroxy-2-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]-6-(hydroxymethyl)pyran-4-one Traditional Name: 3-hydroxy-2-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]-6-methylol-pyran-4-one Formula: C13H22N2O5+2 MolecularWeight: 286.32418

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CCO)CC2=C(C(=O)C=C(O2)CO)O

Isomeric SMILES

C1C[NH+](CC[NH+]1CCO)CC2=C(C(=O)C=C(O2)CO)O

InChI

InChI=1S/C13H20N2O5/c16-6-5-14-1-3-15(4-2-14)8-12-13(19)11(18)7-10(9-17)20-12/h7,16-17,19H,1-6,8-9H2/p+2