trisodium tris(2-nonylphenyl) phosphite phosphite

Systemtic Name: trisodium tris(2-nonylphenyl) phosphite phosphite Openeye Name: trisodium tris(2-nonylphenyl) phosphite phosphite CAS Name: trisodium phosphorous acid tris(2-nonylphenyl) ester phosphite IUPAC Name: trisodium tris(2-nonylphenyl) phosphite phosphite Traditional Name: trisodium phosphorous acid tris(2-nonylphenyl) ester phosphite Formula: C135H207Na3O12P4 MolecularWeight: 2214.945234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=CC=C1OP(OC2=CC=CC=C2CCCCCCCCC)OC3=CC=CC=C3CCCCCCCCC.CCCCCCCCCC1=CC=CC=C1OP(OC2=CC=CC=C2CCCCCCCCC)OC3=CC=CC=C3CCCCCCCCC.CCCCCCCCCC1=CC=CC=C1OP(OC2=CC=CC=C2CCCCCCCCC)OC3=CC=CC=C3CCCCCCCCC.[O-]P([O-])[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

CCCCCCCCCC1=CC=CC=C1OP(OC2=CC=CC=C2CCCCCCCCC)OC3=CC=CC=C3CCCCCCCCC.CCCCCCCCCC1=CC=CC=C1OP(OC2=CC=CC=C2CCCCCCCCC)OC3=CC=CC=C3CCCCCCCCC.CCCCCCCCCC1=CC=CC=C1OP(OC2=CC=CC=C2CCCCCCCCC)OC3=CC=CC=C3CCCCCCCCC.[O-]P([O-])[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/3C45H69O3P.3Na.O3P/c3*1-4-7-10-13-16-19-22-31-40-34-25-28-37-43(40)46-49(47-44-38-29-26-35-41(44)32-23-20-17-14-11-8-5-2)48-45-39-30-27-36-42(45)33-24-21-18-15-12-9-6-3;;;;1-4(2)3/h3*25-30,34-39H,4-24,31-33H2,1-3H3;;;;/q;;;3*+1;-3