cyclohexyl-(2-cyclopentyl-2-oxidanylidene-ethyl)-methyl-sulfanium; 4-methylbenzenesulfonate

Systemtic Name: cyclohexyl-(2-cyclopentyl-2-oxidanylidene-ethyl)-methyl-sulfanium; 4-methylbenzenesulfonate Openeye Name: cyclohexyl-(2-cyclopentyl-2-oxo-ethyl)-methyl-sulfonium; 4-methylbenzenesulfonate CAS Name: cyclohexyl-(2-cyclopentyl-2-oxoethyl)-methylsulfonium; 4-methylbenzenesulfonate IUPAC Name: cyclohexyl-(2-cyclopentyl-2-oxoethyl)-methylsulfanium; 4-methylbenzenesulfonate Traditional Name: cyclohexyl-(2-cyclopentyl-2-keto-ethyl)-methyl-sulfonium tosylate Formula: C21H32O4S2 MolecularWeight: 412.60638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[S+](CC(=O)C1CCCC1)C2CCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[S+](CC(=O)C1CCCC1)C2CCCCC2

InChI

InChI=1S/C14H25OS.C7H8O3S/c1-16(13-9-3-2-4-10-13)11-14(15)12-7-5-6-8-12;1-6-2-4-7(5-3-6)11(8,9)10/h12-13H,2-11H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1