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diphenyl phosphate; tridodecyl(methyl)azanium

diphenyl phosphate; tridodecyl(methyl)azanium

Systemtic Name:diphenyl phosphate; tridodecyl(methyl)azanium
Openeye Name:diphenyl phosphate; tridodecyl(methyl)ammonium
CAS Name:diphenyl phosphate; tridodecyl(methyl)ammonium
IUPAC Name:diphenyl phosphate; tridodecyl(methyl)azanium
Traditional Name:diphenyl phosphate; trilauryl(methyl)ammonium
Formula: C49H88NO4P
MolecularWeight: 786.201081
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](C)(CCCCCCCCCCCC)CCCCCCCCCCCC.C1=CC=C(C=C1)OP(=O)([O-])OC2=CC=CC=C2


Isomeric SMILES

CCCCCCCCCCCC[N+](C)(CCCCCCCCCCCC)CCCCCCCCCCCC.C1=CC=C(C=C1)OP(=O)([O-])OC2=CC=CC=C2


InChI

InChI=1S/C37H78N.C12H11O4P/c1-5-8-11-14-17-20-23-26-29-32-35-38(4,36-33-30-27-24-21-18-15-12-9-6-2)37-34-31-28-25-22-19-16-13-10-7-3;13-17(14,15-11-7-3-1-4-8-11)16-12-9-5-2-6-10-12/h5-37H2,1-4H3;1-10H,(H,13,14)/q+1;/p-1


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