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benzene; ethyl-hexadecyl-dimethyl-azanium; sulfate

benzene; ethyl-hexadecyl-dimethyl-azanium; sulfate

Systemtic Name:benzene; ethyl-hexadecyl-dimethyl-azanium; sulfate
Openeye Name:benzene; ethyl-hexadecyl-dimethyl-ammonium; sulfate
CAS Name:benzene; ethyl-hexadecyl-dimethylammonium; sulfate
IUPAC Name:benzene; ethyl-hexadecyl-dimethylazanium; sulfate
Traditional Name:benzene; cetyl-ethyl-dimethyl-ammonium; sulfate
Formula: C26H50NO4S-
MolecularWeight: 472.7445
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C20H44N.C6H6.H2O4S/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(3,4)6-2;1-2-4-6-5-3-1;1-5(2,3)4/h5-20H2,1-4H3;1-6H;(H2,1,2,3,4)/q+1;;/p-2


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