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azanium 1,2-didodecylbenzene thiophosphate

azanium 1,2-didodecylbenzene thiophosphate

Systemtic Name:azanium 1,2-didodecylbenzene thiophosphate
Openeye Name:ammonium 1,2-didodecylbenzene thiophosphate
CAS Name:ammonium 1,2-didodecylbenzene thiophosphate
IUPAC Name:azanium 1,2-didodecylbenzene thiophosphate
Traditional Name:ammonium 1,2-dilaurylbenzene thiophosphate
Formula: C30H58NO3PS-2
MolecularWeight: 543.825181
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1CCCCCCCCCCCC.[NH4+].[O-]P(=S)([O-])[O-]


Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1CCCCCCCCCCCC.[NH4+].[O-]P(=S)([O-])[O-]


InChI

InChI=1S/C30H54.H3N.H3O3PS/c1-3-5-7-9-11-13-15-17-19-21-25-29-27-23-24-28-30(29)26-22-20-18-16-14-12-10-8-6-4-2;;1-4(2,3)5/h23-24,27-28H,3-22,25-26H2,1-2H3;1H3;(H3,1,2,3,5)/p-2


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