4-azaniumylbutylazanium; bis[2-(2-nonoxyethoxy)ethyl] phosphate

Systemtic Name: 4-azaniumylbutylazanium; bis[2-(2-nonoxyethoxy)ethyl] phosphate Openeye Name: 4-azaniumylbutylammonium; bis[2-(2-nonoxyethoxy)ethyl] phosphate CAS Name: 4-ammoniobutylammonium; bis[2-(2-nonoxyethoxy)ethyl] phosphate IUPAC Name: 4-azaniumylbutylazanium; bis[2-(2-nonoxyethoxy)ethyl] phosphate Traditional Name: 4-ammoniobutylammonium; bis[2-(2-nonoxyethoxy)ethyl] phosphate Formula: C56H122N2O16P2 MolecularWeight: 1141.519202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOCCOCCOP(=O)([O-])OCCOCCOCCCCCCCCC.CCCCCCCCCOCCOCCOP(=O)([O-])OCCOCCOCCCCCCCCC.C(CC[NH3+])C[NH3+]

Isomeric SMILES

CCCCCCCCCOCCOCCOP(=O)([O-])OCCOCCOCCCCCCCCC.CCCCCCCCCOCCOCCOP(=O)([O-])OCCOCCOCCCCCCCCC.C(CC[NH3+])C[NH3+]

InChI

InChI=1S/2C26H55O8P.C4H12N2/c2*1-3-5-7-9-11-13-15-17-29-19-21-31-23-25-33-35(27,28)34-26-24-32-22-20-30-18-16-14-12-10-8-6-4-2;5-3-1-2-4-6/h2*3-26H2,1-2H3,(H,27,28);1-6H2