3-[1-[1-(1-methoxyethoxy)ethoxy]ethyl]-1,3-thiazol-3-ium-2-amine; 4-methylbenzenesulfonate

Systemtic Name: 3-[1-[1-(1-methoxyethoxy)ethoxy]ethyl]-1,3-thiazol-3-ium-2-amine; 4-methylbenzenesulfonate Openeye Name: 3-[1-[1-(1-methoxyethoxy)ethoxy]ethyl]thiazol-3-ium-2-amine; 4-methylbenzenesulfonate CAS Name: 3-[1-[1-(1-methoxyethoxy)ethoxy]ethyl]-2-thiazol-3-iumamine; 4-methylbenzenesulfonate IUPAC Name: 3-[1-[1-(1-methoxyethoxy)ethoxy]ethyl]-1,3-thiazol-3-ium-2-amine; 4-methylbenzenesulfonate Traditional Name: [3-[1-[1-(1-methoxyethoxy)ethoxy]ethyl]thiazol-3-ium-2-yl]amine tosylate Formula: C17H26N2O6S2 MolecularWeight: 418.52814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].CC([N+]1=C(SC=C1)N)OC(C)OC(C)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].CC([N+]1=C(SC=C1)N)OC(C)OC(C)OC

InChI

InChI=1S/C10H18N2O3S.C7H8O3S/c1-7(12-5-6-16-10(12)11)14-9(3)15-8(2)13-4;1-6-2-4-7(5-3-6)11(8,9)10/h5-9,11H,1-4H3;2-5H,1H3,(H,8,9,10)