cerium(4+); 2-ethylhexanoate; 4-methylbenzenesulfonate

Systemtic Name: cerium(4+); 2-ethylhexanoate; 4-methylbenzenesulfonate Openeye Name: cerium(4+); 2-ethylhexanoate; 4-methylbenzenesulfonate CAS Name: cerium(4+); 2-ethylhexanoate; 4-methylbenzenesulfonate IUPAC Name: cerium(4+); 2-ethylhexanoate; 4-methylbenzenesulfonate Traditional Name: cerium(4+); 2-ethylhexanoate; ditosylate Formula: C30H44CeO10S2 MolecularWeight: 768.91036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].[Ce+4]

Isomeric SMILES

CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].[Ce+4]

InChI

InChI=1S/2C8H16O2.2C7H8O3S.Ce/c2*1-3-5-6-7(4-2)8(9)10;2*1-6-2-4-7(5-3-6)11(8,9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);2*2-5H,1H3,(H,8,9,10);/q;;;;+4/p-4