4-methylbenzenesulfonate; [4-(oxolan-2-yloxy)phenyl]-diphenyl-sulfanium

Systemtic Name: 4-methylbenzenesulfonate; [4-(oxolan-2-yloxy)phenyl]-diphenyl-sulfanium Openeye Name: diphenyl-(4-tetrahydrofuran-2-yloxyphenyl)sulfonium; 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonate; [4-(2-oxolanyloxy)phenyl]-diphenylsulfonium IUPAC Name: 4-methylbenzenesulfonate; [4-(oxolan-2-yloxy)phenyl]-diphenylsulfanium Traditional Name: diphenyl-[4-(tetrahydrofuryloxy)phenyl]sulfonium tosylate Formula: C29H28O5S2 MolecularWeight: 520.65962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1CC(OC1)OC2=CC=C(C=C2)[S+](C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1CC(OC1)OC2=CC=C(C=C2)[S+](C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H21O2S.C7H8O3S/c1-3-8-19(9-4-1)25(20-10-5-2-6-11-20)21-15-13-18(14-16-21)24-22-12-7-17-23-22;1-6-2-4-7(5-3-6)11(8,9)10/h1-6,8-11,13-16,22H,7,12,17H2;2-5H,1H3,(H,8,9,10)/q+1;/p-1