(2-tert-butylphenyl)-diphenyl-sulfanium; 4,7,7-trimethyl-3-oxidanylidene-bicyclo[2.2.1]heptane-2-sulfonate

Systemtic Name: (2-tert-butylphenyl)-diphenyl-sulfanium; 4,7,7-trimethyl-3-oxidanylidene-bicyclo[2.2.1]heptane-2-sulfonate Openeye Name: (2-tert-butylphenyl)-diphenyl-sulfonium; 4,7,7-trimethyl-3-oxo-norbornane-2-sulfonate CAS Name: (2-tert-butylphenyl)-diphenylsulfonium; 4,7,7-trimethyl-3-oxo-2-bicyclo[2.2.1]heptanesulfonate IUPAC Name: (2-tert-butylphenyl)-diphenylsulfanium; 4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-2-sulfonate Traditional Name: (2-tert-butylphenyl)-diphenyl-sulfonium; 3-keto-4,7,7-trimethyl-norbornane-2-sulfonate Formula: C32H38O4S2 MolecularWeight: 550.77172

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(=O)C2S(=O)(=O)[O-])C)C.CC(C)(C)C1=CC=CC=C1[S+](C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1(C2CCC1(C(=O)C2S(=O)(=O)[O-])C)C.CC(C)(C)C1=CC=CC=C1[S+](C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H23S.C10H16O4S/c1-22(2,3)20-16-10-11-17-21(20)23(18-12-6-4-7-13-18)19-14-8-5-9-15-19;1-9(2)6-4-5-10(9,3)8(11)7(6)15(12,13)14/h4-17H,1-3H3;6-7H,4-5H2,1-3H3,(H,12,13,14)/q+1;/p-1