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1-(4-methylphenyl)tridecane-1-sulfonate; octadecylazanium

1-(4-methylphenyl)tridecane-1-sulfonate; octadecylazanium

Systemtic Name:1-(4-methylphenyl)tridecane-1-sulfonate; octadecylazanium
Openeye Name:octadecylammonium; 1-(p-tolyl)tridecane-1-sulfonate
CAS Name:1-(4-methylphenyl)-1-tridecanesulfonate; octadecylammonium
IUPAC Name:1-(4-methylphenyl)tridecane-1-sulfonate; octadecylazanium
Traditional Name:1-(p-tolyl)tridecane-1-sulfonate; stearylammonium
Formula: C38H73NO3S
MolecularWeight: 624.05612
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[NH3+].CCCCCCCCCCCCC(C1=CC=C(C=C1)C)S(=O)(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCCCC[NH3+].CCCCCCCCCCCCC(C1=CC=C(C=C1)C)S(=O)(=O)[O-]


InChI

InChI=1S/C20H34O3S.C18H39N/c1-3-4-5-6-7-8-9-10-11-12-13-20(24(21,22)23)19-16-14-18(2)15-17-19;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h14-17,20H,3-13H2,1-2H3,(H,21,22,23);2-19H2,1H3


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