(4-tert-butylphenyl)-diphenyl-sulfanium; 2-dodecylbenzenesulfonate

Systemtic Name: (4-tert-butylphenyl)-diphenyl-sulfanium; 2-dodecylbenzenesulfonate Openeye Name: (4-tert-butylphenyl)-diphenyl-sulfonium; 2-dodecylbenzenesulfonate CAS Name: (4-tert-butylphenyl)-diphenylsulfonium; 2-dodecylbenzenesulfonate IUPAC Name: (4-tert-butylphenyl)-diphenylsulfanium; 2-dodecylbenzenesulfonate Traditional Name: (4-tert-butylphenyl)-diphenyl-sulfonium; 2-laurylbesylate Formula: C40H52O3S2 MolecularWeight: 644.96908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].CC(C)(C)C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].CC(C)(C)C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H23S.C18H30O3S/c1-22(2,3)18-14-16-21(17-15-18)23(19-10-6-4-7-11-19)20-12-8-5-9-13-20;1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21/h4-17H,1-3H3;12-13,15-16H,2-11,14H2,1H3,(H,19,20,21)/q+1;/p-1