diphenyl-(4-phenylsulfanylphenyl)sulfanium; 2-dodecylbenzenesulfonate

Systemtic Name: diphenyl-(4-phenylsulfanylphenyl)sulfanium; 2-dodecylbenzenesulfonate Openeye Name: diphenyl-(4-phenylsulfanylphenyl)sulfonium; 2-dodecylbenzenesulfonate CAS Name: diphenyl-[4-(phenylthio)phenyl]sulfonium; 2-dodecylbenzenesulfonate IUPAC Name: diphenyl-(4-phenylsulfanylphenyl)sulfanium; 2-dodecylbenzenesulfonate Traditional Name: diphenyl-[4-(phenylthio)phenyl]sulfonium; 2-laurylbesylate Formula: C42H48O3S3 MolecularWeight: 697.02372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].C1=CC=C(C=C1)SC2=CC=C(C=C2)[S+](C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].C1=CC=C(C=C1)SC2=CC=C(C=C2)[S+](C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H19S2.C18H30O3S/c1-4-10-20(11-5-1)25-21-16-18-24(19-17-21)26(22-12-6-2-7-13-22)23-14-8-3-9-15-23;1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21/h1-19H;12-13,15-16H,2-11,14H2,1H3,(H,19,20,21)/q+1;/p-1