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benzenesulfonate; 1-dodecyl-4-methyl-pyridin-1-ium

benzenesulfonate; 1-dodecyl-4-methyl-pyridin-1-ium

Systemtic Name:benzenesulfonate; 1-dodecyl-4-methyl-pyridin-1-ium
Openeye Name:benzenesulfonate; 1-dodecyl-4-methyl-pyridin-1-ium
CAS Name:benzenesulfonate; 1-dodecyl-4-methylpyridin-1-ium
IUPAC Name:benzenesulfonate; 1-dodecyl-4-methylpyridin-1-ium
Traditional Name:1-lauryl-4-methyl-pyridin-1-ium besylate
Formula: C24H37NO3S
MolecularWeight: 419.62048
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+]1=CC=C(C=C1)C.C1=CC=C(C=C1)S(=O)(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCC[N+]1=CC=C(C=C1)C.C1=CC=C(C=C1)S(=O)(=O)[O-]


InChI

InChI=1S/C18H32N.C6H6O3S/c1-3-4-5-6-7-8-9-10-11-12-15-19-16-13-18(2)14-17-19;7-10(8,9)6-4-2-1-3-5-6/h13-14,16-17H,3-12,15H2,1-2H3;1-5H,(H,7,8,9)/q+1;/p-1


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