5,5-dimethyl-2-[[[2-methyl-1,3-bis(oxidanyl)propan-2-yl]amino]methylidene]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[[[2-methyl-1,3-bis(oxidanyl)propan-2-yl]amino]methylidene]cyclohexane-1,3-dione Openeye Name: 2-[[[2-hydroxy-1-(hydroxymethyl)-1-methyl-ethyl]amino]methylene]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[[(1,3-dihydroxy-2-methylpropan-2-yl)amino]methylidene]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[[(1,3-dihydroxy-2-methylpropan-2-yl)amino]methylidene]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[[(2-hydroxy-1-methyl-1-methylol-ethyl)amino]methylene]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C13H21NO4 MolecularWeight: 255.31014

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=CNC(C)(CO)CO)C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=CNC(C)(CO)CO)C(=O)C1)C

InChI

InChI=1S/C13H21NO4/c1-12(2)4-10(17)9(11(18)5-12)6-14-13(3,7-15)8-16/h6,14-16H,4-5,7-8H2,1-3H3