4-methylbenzenesulfonate; [3-(oxan-2-yloxy)phenyl]-diphenyl-sulfanium

Systemtic Name: 4-methylbenzenesulfonate; [3-(oxan-2-yloxy)phenyl]-diphenyl-sulfanium Openeye Name: diphenyl-(3-tetrahydropyran-2-yloxyphenyl)sulfonium; 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonate; [3-(2-oxanyloxy)phenyl]-diphenylsulfonium IUPAC Name: 4-methylbenzenesulfonate; [3-(oxan-2-yloxy)phenyl]-diphenylsulfanium Traditional Name: diphenyl-(3-tetrahydropyran-2-yloxyphenyl)sulfonium tosylate Formula: C30H30O5S2 MolecularWeight: 534.6862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1CCOC(C1)OC2=CC(=CC=C2)[S+](C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1CCOC(C1)OC2=CC(=CC=C2)[S+](C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H23O2S.C7H8O3S/c1-3-11-20(12-4-1)26(21-13-5-2-6-14-21)22-15-9-10-19(18-22)25-23-16-7-8-17-24-23;1-6-2-4-7(5-3-6)11(8,9)10/h1-6,9-15,18,23H,7-8,16-17H2;2-5H,1H3,(H,8,9,10)/q+1;/p-1