magnesium (E)-2-cyano-1-(2,4-dichlorophenyl)-4,4-dimethyl-3-oxidanylidene-pent-1-en-1-olate

Systemtic Name: magnesium (E)-2-cyano-1-(2,4-dichlorophenyl)-4,4-dimethyl-3-oxidanylidene-pent-1-en-1-olate Openeye Name: magnesium (E)-2-cyano-1-(2,4-dichlorophenyl)-4,4-dimethyl-3-oxo-pent-1-en-1-olate CAS Name: magnesium (E)-2-cyano-1-(2,4-dichlorophenyl)-4,4-dimethyl-3-oxo-1-penten-1-olate IUPAC Name: magnesium (E)-2-cyano-1-(2,4-dichlorophenyl)-4,4-dimethyl-3-oxopent-1-en-1-olate Traditional Name: magnesium (E)-2-cyano-1-(2,4-dichlorophenyl)-3-keto-4,4-dimethyl-pent-1-en-1-olate Formula: C28H24Cl4MgN2O4 MolecularWeight: 618.61816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=C(C1=C(C=C(C=C1)Cl)Cl)[O-])C#N.CC(C)(C)C(=O)C(=C(C1=C(C=C(C=C1)Cl)Cl)[O-])C#N.[Mg+2]

Isomeric SMILES

CC(C(=O)/C(=C(/[O-])\C1=C(C=C(C=C1)Cl)Cl)/C#N)(C)C.CC(C(=O)/C(=C(/[O-])\C1=C(C=C(C=C1)Cl)Cl)/C#N)(C)C.[Mg+2]

InChI

InChI=1S/2C14H13Cl2NO2.Mg/c2*1-14(2,3)13(19)10(7-17)12(18)9-5-4-8(15)6-11(9)16;/h2*4-6,18H,1-3H3;/q;;+2/p-2/b2*12-10+;