4-(diphenylmethyl)benzenesulfonate; [4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenyl-sulfanium

Systemtic Name: 4-(diphenylmethyl)benzenesulfonate; [4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenyl-sulfanium Openeye Name: 4-benzhydrylbenzenesulfonate; (4-tert-butoxyphenyl)-diphenyl-sulfonium CAS Name: 4-(diphenylmethyl)benzenesulfonate; [4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfonium IUPAC Name: 4-benzhydrylbenzenesulfonate; [4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium Traditional Name: 4-benzhydrylbesylate; (4-tert-butoxyphenyl)-diphenyl-sulfonium Formula: C41H38O4S2 MolecularWeight: 658.86802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)OC1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)[O-]

InChI

InChI=1S/C22H23OS.C19H16O3S/c1-22(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;20-23(21,22)18-13-11-17(12-14-18)19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h4-17H,1-3H3;1-14,19H,(H,20,21,22)/q+1;/p-1