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1-dodecyl-2,3-dimethyl-imidazol-3-ium; 4-methylbenzenesulfonate

1-dodecyl-2,3-dimethyl-imidazol-3-ium; 4-methylbenzenesulfonate

Systemtic Name:1-dodecyl-2,3-dimethyl-imidazol-3-ium; 4-methylbenzenesulfonate
Openeye Name:1-dodecyl-2,3-dimethyl-imidazol-3-ium; 4-methylbenzenesulfonate
CAS Name:1-dodecyl-2,3-dimethylimidazol-3-ium; 4-methylbenzenesulfonate
IUPAC Name:1-dodecyl-2,3-dimethylimidazol-3-ium; 4-methylbenzenesulfonate
Traditional Name:1-lauryl-2,3-dimethyl-imidazol-3-ium tosylate
Formula: C24H40N2O3S
MolecularWeight: 436.651
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1C=C[N+](=C1C)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCN1C=C[N+](=C1C)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]


InChI

InChI=1S/C17H33N2.C7H8O3S/c1-4-5-6-7-8-9-10-11-12-13-14-19-16-15-18(3)17(19)2;1-6-2-4-7(5-3-6)11(8,9)10/h15-16H,4-14H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1


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