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

Systemtic Name: 4-[[2-(hexadecoxymethyl)-4-oxidanylidene-pentoxy]-oxidanyl-phosphanyl]oxybutyl-methyl-azanium Openeye Name: 4-[[2-(hexadecoxymethyl)-4-oxo-pentoxy]-hydroxy-phosphanyl]oxybutyl-methyl-ammonium CAS Name: 4-[[2-(hexadecoxymethyl)-4-oxopentoxy]-hydroxyphosphino]oxybutyl-methylammonium IUPAC Name: 4-[[2-(hexadecoxymethyl)-4-oxopentoxy]-hydroxyphosphanyl]oxybutyl-methylazanium Traditional Name: 4-[[2-(cetyloxymethyl)-4-keto-pentoxy]-hydroxy-phosphino]oxybutyl-methyl-ammonium Formula: C27H57NO5P+ MolecularWeight: 506.718941

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(CC(=O)C)COP(O)OCCCC[NH2+]C

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(CC(=O)C)COP(O)OCCCC[NH2+]C

InChI

InChI=1S/C27H56NO5P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-31-24-27(23-26(2)29)25-33-34(30)32-22-19-17-20-28-3/h27-28,30H,4-25H2,1-3H3/p+1