nickel; (6Z)-6-[(1-oxidanylbutan-2-ylamino)methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: nickel; (6Z)-6-[(1-oxidanylbutan-2-ylamino)methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-[[1-(hydroxymethyl)propylamino]methylene]cyclohexa-2,4-dien-1-one; nickel CAS Name: (6Z)-6-[(1-hydroxybutan-2-ylamino)methylidene]-1-cyclohexa-2,4-dienone; nickel IUPAC Name: (6Z)-6-[(1-hydroxybutan-2-ylamino)methylidene]cyclohexa-2,4-dien-1-one; nickel Traditional Name: (6Z)-6-[(1-methylolpropylamino)methylene]cyclohexa-2,4-dien-1-one; nickel Formula: C22H30N2NiO4 MolecularWeight: 445.178

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC=C1C=CC=CC1=O.CCC(CO)NC=C1C=CC=CC1=O.[Ni]

Isomeric SMILES

CCC(N/C=C/1\C(=O)C=CC=C1)CO.CCC(N/C=C/1\C(=O)C=CC=C1)CO.[Ni]

InChI

InChI=1S/2C11H15NO2.Ni/c2*1-2-10(8-13)12-7-9-5-3-4-6-11(9)14;/h2*3-7,10,12-13H,2,8H2,1H3;/b2*9-7-;