2-(2-azanylethoxy)ethyl [4-(dioctadecylamino)-3-methyl-4-oxidanylidene-butyl] hydrogen phosphate

Systemtic Name: 2-(2-azanylethoxy)ethyl [4-(dioctadecylamino)-3-methyl-4-oxidanylidene-butyl] hydrogen phosphate Openeye Name: 2-(2-aminoethoxy)ethyl [4-(dioctadecylamino)-3-methyl-4-oxo-butyl] hydrogen phosphate CAS Name: 2-(2-aminoethoxy)ethyl [4-(dioctadecylamino)-3-methyl-4-oxobutyl] hydrogen phosphate IUPAC Name: 2-(2-aminoethoxy)ethyl [4-(dioctadecylamino)-3-methyl-4-oxobutyl] hydrogen phosphate Traditional Name: 2-(2-aminoethoxy)ethyl [4-(distearylamino)-4-keto-3-methyl-butyl] hydrogen phosphate Formula: C45H93N2O6P MolecularWeight: 789.203481

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C(=O)C(C)CCOP(=O)(O)OCCOCCN

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C(=O)C(C)CCOP(=O)(O)OCCOCCN

InChI

InChI=1S/C45H93N2O6P/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-38-47(45(48)44(3)36-40-52-54(49,50)53-43-42-51-41-37-46)39-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h44H,4-43,46H2,1-3H3,(H,49,50)