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azanium 2-[2,4-di(nonyl)phenoxy]ethyl sulfate

azanium 2-[2,4-di(nonyl)phenoxy]ethyl sulfate

Systemtic Name:azanium 2-[2,4-di(nonyl)phenoxy]ethyl sulfate
Openeye Name:ammonium 2-[2,4-di(nonyl)phenoxy]ethyl sulfate
CAS Name:ammonium 2-[2,4-di(nonyl)phenoxy]ethyl sulfate
IUPAC Name:azanium 2-[2,4-di(nonyl)phenoxy]ethyl sulfate
Traditional Name:ammonium 2-[2,4-di(nonyl)phenoxy]ethyl sulfate
Formula: C26H49NO5S
MolecularWeight: 487.73596
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC(=C(C=C1)OCCOS(=O)(=O)[O-])CCCCCCCCC.[NH4+]


Isomeric SMILES

CCCCCCCCCC1=CC(=C(C=C1)OCCOS(=O)(=O)[O-])CCCCCCCCC.[NH4+]


InChI

InChI=1S/C26H46O5S.H3N/c1-3-5-7-9-11-13-15-17-24-19-20-26(30-21-22-31-32(27,28)29)25(23-24)18-16-14-12-10-8-6-4-2;/h19-20,23H,3-18,21-22H2,1-2H3,(H,27,28,29);1H3


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