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sodium 1,3-didodecylbenzene-2-ide thiophosphate thiophosphate

sodium 1,3-didodecylbenzene-2-ide thiophosphate thiophosphate

Systemtic Name:sodium 1,3-didodecylbenzene-2-ide thiophosphate thiophosphate
Openeye Name:sodium 1,3-didodecylbenzene-2-ide thiophosphate thiophosphate
CAS Name:sodium 1,3-didodecylbenzene-2-ide thiophosphate thiophosphate
IUPAC Name:sodium 1,3-didodecylbenzene-2-ide thiophosphate thiophosphate
Traditional Name:sodium 1,3-dilaurylbenzene-2-ide thiophosphate thiophosphate
Formula: C30H53NaO6P2S2-6
MolecularWeight: 658.805512
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=[C-]C(=CC=C1)CCCCCCCCCCCC.[O-]P(=S)([O-])[O-].[O-]P(=O)([O-])[S-].[Na+]


Isomeric SMILES

CCCCCCCCCCCCC1=[C-]C(=CC=C1)CCCCCCCCCCCC.[O-]P(=S)([O-])[O-].[O-]P(=O)([O-])[S-].[Na+]


InChI

InChI=1S/C30H53.Na.2H3O3PS/c1-3-5-7-9-11-13-15-17-19-21-24-29-26-23-27-30(28-29)25-22-20-18-16-14-12-10-8-6-4-2;;2*1-4(2,3)5/h23,26-27H,3-22,24-25H2,1-2H3;;2*(H3,1,2,3,5)/q-1;+1;;/p-6


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