4-methylbenzenesulfonate; 5-(oxolan-2-yl)pentyl-bis(phenylmethyl)sulfanium

Systemtic Name: 4-methylbenzenesulfonate; 5-(oxolan-2-yl)pentyl-bis(phenylmethyl)sulfanium Openeye Name: dibenzyl(5-tetrahydrofuran-2-ylpentyl)sulfonium; 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonate; 5-(2-oxolanyl)pentyl-bis(phenylmethyl)sulfonium IUPAC Name: dibenzyl-[5-(oxolan-2-yl)pentyl]sulfanium; 4-methylbenzenesulfonate Traditional Name: dibenzyl-[5-(tetrahydrofuryl)pentyl]sulfonium tosylate Formula: C30H38O4S2 MolecularWeight: 526.75032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1CC(OC1)CCCCC[S+](CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1CC(OC1)CCCCC[S+](CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C23H31OS.C7H8O3S/c1-4-11-21(12-5-1)19-25(20-22-13-6-2-7-14-22)18-9-3-8-15-23-16-10-17-24-23;1-6-2-4-7(5-3-6)11(8,9)10/h1-2,4-7,11-14,23H,3,8-10,15-20H2;2-5H,1H3,(H,8,9,10)/q+1;/p-1