6,7-bis-(4-methylphenyl)sulfonyloxynaphthalene-2-sulfonate; [4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenyl-sulfanium

Systemtic Name: 6,7-bis-(4-methylphenyl)sulfonyloxynaphthalene-2-sulfonate; [4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenyl-sulfanium Openeye Name: 6,7-bis(p-tolylsulfonyloxy)naphthalene-2-sulfonate; (4-tert-butoxyphenyl)-diphenyl-sulfonium CAS Name: 6,7-bis-(4-methylphenyl)sulfonyloxy-2-naphthalenesulfonate; [4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfonium IUPAC Name: 6,7-bis-(4-methylphenyl)sulfonyloxynaphthalene-2-sulfonate; [4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium Traditional Name: (4-tert-butoxyphenyl)-diphenyl-sulfonium; 6,7-ditosyloxynaphthalene-2-sulfonate Formula: C46H42O10S4 MolecularWeight: 883.07968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C3C=C(C=CC3=C2)S(=O)(=O)[O-])OS(=O)(=O)C4=CC=C(C=C4)C.CC(C)(C)OC1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C3C=C(C=CC3=C2)S(=O)(=O)[O-])OS(=O)(=O)C4=CC=C(C=C4)C.CC(C)(C)OC1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H20O9S3.C22H23OS/c1-16-3-8-20(9-4-16)35(28,29)32-23-14-18-7-12-22(34(25,26)27)13-19(18)15-24(23)33-36(30,31)21-10-5-17(2)6-11-21;1-22(2,3)23-18-14-16-21(17-15-18)24(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h3-15H,1-2H3,(H,25,26,27);4-17H,1-3H3/q;+1/p-1