6-[[[2-methyl-1,3-bis(oxidanyl)propan-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one; nickel; piperidin-1-ide; 2H-pyridin-1-ide

Systemtic Name: 6-[[[2-methyl-1,3-bis(oxidanyl)propan-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one; nickel; piperidin-1-ide; 2H-pyridin-1-ide Openeye Name: 6-[[[2-hydroxy-1-(hydroxymethyl)-1-methyl-ethyl]amino]methylene]cyclohexa-2,4-dien-1-one; nickel; piperidin-1-ide; 2H-pyridin-1-ide CAS Name: 6-[[(1,3-dihydroxy-2-methylpropan-2-yl)amino]methylidene]-1-cyclohexa-2,4-dienone; nickel; piperidin-1-ide; 2H-pyridin-1-ide IUPAC Name: 6-[[(1,3-dihydroxy-2-methylpropan-2-yl)amino]methylidene]cyclohexa-2,4-dien-1-one; nickel; piperidin-1-ide; 2H-pyridin-1-ide Traditional Name: 6-[[(2-hydroxy-1-methyl-1-methylol-ethyl)amino]methylene]cyclohexa-2,4-dien-1-one; nickel; piperidin-1-ide; 2H-pyridin-1-ide Formula: C26H41N4NiO3-3 MolecularWeight: 516.32214

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)NC=C1C=CC=CC1=O.C1CC[N-]CC1.C1CC[N-]CC1.C1C=CC=C[N-]1.[Ni]

Isomeric SMILES

CC(CO)(CO)NC=C1C=CC=CC1=O.C1CC[N-]CC1.C1CC[N-]CC1.C1C=CC=C[N-]1.[Ni]

InChI

InChI=1S/C11H15NO3.2C5H10N.C5H6N.Ni/c1-11(7-13,8-14)12-6-9-4-2-3-5-10(9)15;3*1-2-4-6-5-3-1;/h2-6,12-14H,7-8H2,1H3;2*1-5H2;1-4H,5H2;/q;3*-1;