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4-dodecylbenzenesulfonate; 6-methoxy-1-methyl-quinolin-1-ium

4-dodecylbenzenesulfonate; 6-methoxy-1-methyl-quinolin-1-ium

Systemtic Name:4-dodecylbenzenesulfonate; 6-methoxy-1-methyl-quinolin-1-ium
Openeye Name:4-dodecylbenzenesulfonate; 6-methoxy-1-methyl-quinolin-1-ium
CAS Name:4-dodecylbenzenesulfonate; 6-methoxy-1-methylquinolin-1-ium
IUPAC Name:4-dodecylbenzenesulfonate; 6-methoxy-1-methylquinolin-1-ium
Traditional Name:4-laurylbesylate; 6-methoxy-1-methyl-quinolin-1-ium
Formula: C29H41NO4S
MolecularWeight: 499.70514
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC2=C1C=CC(=C2)OC


Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC2=C1C=CC(=C2)OC


InChI

InChI=1S/C18H30O3S.C11H12NO/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)22(19,20)21;1-12-7-3-4-9-8-10(13-2)5-6-11(9)12/h13-16H,2-12H2,1H3,(H,19,20,21);3-8H,1-2H3/q;+1/p-1


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