4-[[2-(hexadecoxymethyl)-4-oxidanylidene-pentoxy]-oxidanyl-phosphanyl]oxybutyl-dimethyl-azanium

Systemtic Name: 4-[[2-(hexadecoxymethyl)-4-oxidanylidene-pentoxy]-oxidanyl-phosphanyl]oxybutyl-dimethyl-azanium Openeye Name: 4-[[2-(hexadecoxymethyl)-4-oxo-pentoxy]-hydroxy-phosphanyl]oxybutyl-dimethyl-ammonium CAS Name: 4-[[2-(hexadecoxymethyl)-4-oxopentoxy]-hydroxyphosphino]oxybutyl-dimethylammonium IUPAC Name: 4-[[2-(hexadecoxymethyl)-4-oxopentoxy]-hydroxyphosphanyl]oxybutyl-dimethylazanium Traditional Name: 4-[[2-(cetyloxymethyl)-4-keto-pentoxy]-hydroxy-phosphino]oxybutyl-dimethyl-ammonium Formula: C28H59NO5P+ MolecularWeight: 520.745521

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(CC(=O)C)COP(O)OCCCC[NH+](C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(CC(=O)C)COP(O)OCCCC[NH+](C)C

InChI

InChI=1S/C28H58NO5P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-32-25-28(24-27(2)30)26-34-35(31)33-23-20-18-21-29(3)4/h28,31H,5-26H2,1-4H3/p+1