cadmium(2+); methylbenzene; 4-methylbenzenesulfonate

Systemtic Name: cadmium(2+); methylbenzene; 4-methylbenzenesulfonate Openeye Name: cadmium(2+); 4-methylbenzenesulfonate; toluene CAS Name: cadmium(2+); 4-methylbenzenesulfonate; toluene IUPAC Name: cadmium(2+); 4-methylbenzenesulfonate; toluene Traditional Name: cadmium(2+); toluene; ditosylate Formula: C28H30CdO6S2 MolecularWeight: 639.0752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.CC1=CC=CC=C1.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].[Cd+2]

Isomeric SMILES

CC1=CC=CC=C1.CC1=CC=CC=C1.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].[Cd+2]

InChI

InChI=1S/2C7H8O3S.2C7H8.Cd/c2*1-6-2-4-7(5-3-6)11(8,9)10;2*1-7-5-3-2-4-6-7;/h2*2-5H,1H3,(H,8,9,10);2*2-6H,1H3;/q;;;;+2/p-2