dialuminum; 16-methylheptadecyl phosphate; zirconium(4+)

Systemtic Name: dialuminum; 16-methylheptadecyl phosphate; zirconium(4+) Openeye Name: dialuminum; 16-methylheptadecyl phosphate; zirconium(4+) CAS Name: dialuminum; 16-methylheptadecyl phosphate; zirconium(4+) IUPAC Name: dialuminum; 16-methylheptadecyl phosphate; zirconium(4+) Traditional Name: dialuminum; 16-methylheptadecyl phosphate; zirconium(4+) Formula: C126H259Al2O28P7Zr2 MolecularWeight: 2675.615263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCCCOP(=O)([O-])[O-].CC(C)CCCCCCCCCCCCCCCOP(=O)([O-])[O-].CC(C)CCCCCCCCCCCCCCCOP(=O)([O-])[O-].CC(C)CCCCCCCCCCCCCCCOP(=O)([O-])[O-].CC(C)CCCCCCCCCCCCCCCOP(=O)([O-])[O-].CC(C)CCCCCCCCCCCCCCCOP(=O)([O-])[O-].CC(C)CCCCCCCCCCCCCCCOP(=O)([O-])[O-].[Al+3].[Al+3].[Zr+4].[Zr+4]

Isomeric SMILES

CC(C)CCCCCCCCCCCCCCCOP(=O)([O-])[O-].CC(C)CCCCCCCCCCCCCCCOP(=O)([O-])[O-].CC(C)CCCCCCCCCCCCCCCOP(=O)([O-])[O-].CC(C)CCCCCCCCCCCCCCCOP(=O)([O-])[O-].CC(C)CCCCCCCCCCCCCCCOP(=O)([O-])[O-].CC(C)CCCCCCCCCCCCCCCOP(=O)([O-])[O-].CC(C)CCCCCCCCCCCCCCCOP(=O)([O-])[O-].[Al+3].[Al+3].[Zr+4].[Zr+4]

InChI

InChI=1S/7C18H39O4P.2Al.2Zr/c7*1-18(2)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-22-23(19,20)21;;;;/h7*18H,3-17H2,1-2H3,(H2,19,20,21);;;;/q;;;;;;;2*+3;2*+4/p-14