heptan-3-yl-[5-(oxan-2-yl)pentyl]sulfanium; 4-methylbenzenesulfonate

Systemtic Name: heptan-3-yl-[5-(oxan-2-yl)pentyl]sulfanium; 4-methylbenzenesulfonate Openeye Name: 1-ethylpentyl(5-tetrahydropyran-2-ylpentyl)sulfonium; 4-methylbenzenesulfonate CAS Name: heptan-3-yl-[5-(2-oxanyl)pentyl]sulfonium; 4-methylbenzenesulfonate IUPAC Name: heptan-3-yl-[5-(oxan-2-yl)pentyl]sulfanium; 4-methylbenzenesulfonate Traditional Name: 1-ethylpentyl(5-tetrahydropyran-2-ylpentyl)sulfonium tosylate Formula: C24H42O4S2 MolecularWeight: 458.71788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)[SH+]CCCCCC1CCCCO1.CC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CCCCC(CC)[SH+]CCCCCC1CCCCO1.CC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C17H34OS.C7H8O3S/c1-3-5-13-17(4-2)19-15-10-6-7-11-16-12-8-9-14-18-16;1-6-2-4-7(5-3-6)11(8,9)10/h16-17H,3-15H2,1-2H3;2-5H,1H3,(H,8,9,10)