2-[[2-[3-(4-dodecoxyphenyl)propyl]-4-oxidanylidene-heptoxy]-oxidanyl-phosphoryl]oxyethyl-methyl-azanium

Systemtic Name: 2-[[2-[3-(4-dodecoxyphenyl)propyl]-4-oxidanylidene-heptoxy]-oxidanyl-phosphoryl]oxyethyl-methyl-azanium Openeye Name: 2-[[2-[3-(4-dodecoxyphenyl)propyl]-4-oxo-heptoxy]-hydroxy-phosphoryl]oxyethyl-methyl-ammonium CAS Name: 2-[[2-[3-(4-dodecoxyphenyl)propyl]-4-oxoheptoxy]-hydroxyphosphoryl]oxyethyl-methylammonium IUPAC Name: 2-[[2-[3-(4-dodecoxyphenyl)propyl]-4-oxoheptoxy]-hydroxyphosphoryl]oxyethyl-methylazanium Traditional Name: 2-[hydroxy-[4-keto-2-[3-(4-lauryloxyphenyl)propyl]heptoxy]phosphoryl]oxyethyl-methyl-ammonium Formula: C31H57NO6P+ MolecularWeight: 570.761141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)CCCC(CC(=O)CCC)COP(=O)(O)OCC[NH2+]C

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)CCCC(CC(=O)CCC)COP(=O)(O)OCC[NH2+]C

InChI

InChI=1S/C31H56NO6P/c1-4-6-7-8-9-10-11-12-13-14-24-36-31-21-19-28(20-22-31)17-15-18-29(26-30(33)16-5-2)27-38-39(34,35)37-25-23-32-3/h19-22,29,32H,4-18,23-27H2,1-3H3,(H,34,35)/p+1