3-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-6-methyl-2-oxidanyl-pyran-4-one

Systemtic Name: 3-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 2-hydroxy-3-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-6-methyl-pyran-4-one CAS Name: 2-hydroxy-3-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]-6-methyl-4-pyranone IUPAC Name: 2-hydroxy-3-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-6-methylpyran-4-one Traditional Name: 2-hydroxy-3-[[4-(2-hydroxyethyl)piperazino]methyl]-6-methyl-pyran-4-one Formula: C13H20N2O4 MolecularWeight: 268.3089

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)CN2CCN(CC2)CCO

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)CN2CCN(CC2)CCO

InChI

InChI=1S/C13H20N2O4/c1-10-8-12(17)11(13(18)19-10)9-15-4-2-14(3-5-15)6-7-16/h8,16,18H,2-7,9H2,1H3