2-[2-[3-(hydroxymethyl)piperidin-1-yl]-2-oxidanylidene-ethyl]-1H-pyridazine-3,6-dione

Systemtic Name: 2-[2-[3-(hydroxymethyl)piperidin-1-yl]-2-oxidanylidene-ethyl]-1H-pyridazine-3,6-dione Openeye Name: 2-[2-[3-(hydroxymethyl)-1-piperidyl]-2-oxo-ethyl]-1H-pyridazine-3,6-dione CAS Name: 2-[2-[3-(hydroxymethyl)-1-piperidinyl]-2-oxoethyl]-1H-pyridazine-3,6-dione IUPAC Name: 2-[2-[3-(hydroxymethyl)piperidin-1-yl]-2-oxoethyl]-1H-pyridazine-3,6-dione Traditional Name: 2-[2-keto-2-(3-methylolpiperidino)ethyl]-1H-pyridazine-3,6-quinone Formula: C12H17N3O4 MolecularWeight: 267.28108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CN2C(=O)C=CC(=O)N2)CO

Isomeric SMILES

C1CC(CN(C1)C(=O)CN2C(=O)C=CC(=O)N2)CO

InChI

InChI=1S/C12H17N3O4/c16-8-9-2-1-5-14(6-9)12(19)7-15-11(18)4-3-10(17)13-15/h3-4,9,16H,1-2,5-8H2,(H,13,17)