(1Z,4E)-5-(4-ethoxyphenyl)-3-oxidanylidene-1-phenylazanyl-penta-1,4-dien-1-olate; nickel(2+)

Systemtic Name: (1Z,4E)-5-(4-ethoxyphenyl)-3-oxidanylidene-1-phenylazanyl-penta-1,4-dien-1-olate; nickel(2+) Openeye Name: nickelous (1Z,4E)-1-anilino-5-(4-ethoxyphenyl)-3-oxo-penta-1,4-dien-1-olate CAS Name: (1Z,4E)-1-anilino-5-(4-ethoxyphenyl)-3-oxo-1-penta-1,4-dienolate; nickel(2+) IUPAC Name: (1Z,4E)-1-anilino-5-(4-ethoxyphenyl)-3-oxopenta-1,4-dien-1-olate; nickel(2+) Traditional Name: nickelous (1Z,4E)-1-anilino-3-keto-5-p-phenetyl-penta-1,4-dien-1-olate Formula: C38H36N2NiO6 MolecularWeight: 675.39564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)C=C(NC2=CC=CC=C2)[O-].CCOC1=CC=C(C=C1)C=CC(=O)C=C(NC2=CC=CC=C2)[O-].[Ni+2]

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)/C=C(\[O-])/NC2=CC=CC=C2.CCOC1=CC=C(C=C1)/C=C/C(=O)/C=C(\[O-])/NC2=CC=CC=C2.[Ni+2]

InChI

InChI=1S/2C19H19NO3.Ni/c2*1-2-23-18-12-9-15(10-13-18)8-11-17(21)14-19(22)20-16-6-4-3-5-7-16;/h2*3-14,20,22H,2H2,1H3;/q;;+2/p-2/b2*11-8+,19-14-;