4-methylbenzenesulfonate; methyl-tris(oxiran-2-ylmethyl)azanium

Systemtic Name: 4-methylbenzenesulfonate; methyl-tris(oxiran-2-ylmethyl)azanium Openeye Name: 4-methylbenzenesulfonate; methyl-tris(oxiran-2-ylmethyl)ammonium CAS Name: 4-methylbenzenesulfonate; methyl-tris(2-oxiranylmethyl)ammonium IUPAC Name: 4-methylbenzenesulfonate; methyl-tris(oxiran-2-ylmethyl)azanium Traditional Name: triglycidyl(methyl)ammonium tosylate Formula: C17H25NO6S MolecularWeight: 371.4485

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+](CC1CO1)(CC2CO2)CC3CO3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+](CC1CO1)(CC2CO2)CC3CO3

InChI

InChI=1S/C10H18NO3.C7H8O3S/c1-11(2-8-5-12-8,3-9-6-13-9)4-10-7-14-10;1-6-2-4-7(5-3-6)11(8,9)10/h8-10H,2-7H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1