(4-methylphenyl)-diphenyl-sulfanium; 3-nitro-2,4,6-tri(propan-2-yl)benzenesulfonate

Systemtic Name: (4-methylphenyl)-diphenyl-sulfanium; 3-nitro-2,4,6-tri(propan-2-yl)benzenesulfonate Openeye Name: diphenyl(p-tolyl)sulfonium; 2,4,6-triisopropyl-3-nitro-benzenesulfonate CAS Name: (4-methylphenyl)-diphenylsulfonium; 3-nitro-2,4,6-tri(propan-2-yl)benzenesulfonate IUPAC Name: (4-methylphenyl)-diphenylsulfanium; 3-nitro-2,4,6-tri(propan-2-yl)benzenesulfonate Traditional Name: diphenyl(p-tolyl)sulfonium; 2,4,6-triisopropyl-3-nitro-besylate Formula: C34H39NO5S2 MolecularWeight: 605.80716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17S.C15H23NO5S/c1-16-12-14-19(15-13-16)20(17-8-4-2-5-9-17)18-10-6-3-7-11-18;1-8(2)11-7-12(9(3)4)15(22(19,20)21)13(10(5)6)14(11)16(17)18/h2-15H,1H3;7-10H,1-6H3,(H,19,20,21)/q+1;/p-1