(NE,1Z)-2-(4-chloranyl-2-methyl-phenoxy)-N-ethylidene-ethanehydrazonate; nickel(2+); hydrate

Systemtic Name: (NE,1Z)-2-(4-chloranyl-2-methyl-phenoxy)-N-ethylidene-ethanehydrazonate; nickel(2+); hydrate Openeye Name: nickelous (NE,1Z)-2-(4-chloro-2-methyl-phenoxy)-N-ethylidene-ethanehydrazonate hydrate CAS Name: (NE,1Z)-2-(4-chloro-2-methylphenoxy)-N-ethylideneethanehydrazonate; nickel(2+); hydrate IUPAC Name: (NE,1Z)-2-(4-chloro-2-methylphenoxy)-N-ethylideneethanehydrazonate; nickel(2+); hydrate Traditional Name: nickelous (NE,1Z)-2-(4-chloro-2-methyl-phenoxy)-N-ethylidene-acetohydrazonate hydrate Formula: C22H26Cl2N4NiO5 MolecularWeight: 556.06504

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Descriptors Computed from Structure

Canonical SMILES:

CC=NN=C(COC1=C(C=C(C=C1)Cl)C)[O-].CC=NN=C(COC1=C(C=C(C=C1)Cl)C)[O-].O.[Ni+2]

Isomeric SMILES

C/C=N/N=C(\[O-])/COC1=C(C=C(C=C1)Cl)C.C/C=N/N=C(\[O-])/COC1=C(C=C(C=C1)Cl)C.O.[Ni+2]

InChI

InChI=1S/2C11H13ClN2O2.Ni.H2O/c2*1-3-13-14-11(15)7-16-10-5-4-9(12)6-8(10)2;;/h2*3-6H,7H2,1-2H3,(H,14,15);;1H2/q;;+2;/p-2/b2*13-3+;;