2-[[2-butanoyloxy-5-(4-dodecoxyphenyl)pentoxy]-oxidanyl-phosphanyl]oxyethyl-methyl-azanium

Systemtic Name: 2-[[2-butanoyloxy-5-(4-dodecoxyphenyl)pentoxy]-oxidanyl-phosphanyl]oxyethyl-methyl-azanium Openeye Name: 2-[[2-butanoyloxy-5-(4-dodecoxyphenyl)pentoxy]-hydroxy-phosphanyl]oxyethyl-methyl-ammonium CAS Name: 2-[[5-(4-dodecoxyphenyl)-2-(1-oxobutoxy)pentoxy]-hydroxyphosphino]oxyethyl-methylammonium IUPAC Name: 2-[[2-butanoyloxy-5-(4-dodecoxyphenyl)pentoxy]-hydroxyphosphanyl]oxyethyl-methylazanium Traditional Name: 2-[[2-butyryloxy-5-(4-lauryloxyphenyl)pentoxy]-hydroxy-phosphino]oxyethyl-methyl-ammonium Formula: C30H55NO6P+ MolecularWeight: 556.734561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H54NO6P/c1-4-6-7-8-9-10-11-12-13-14-24-34-28-21-19-27(20-22-28)17-15-18-29(37-30(32)16-5-2)26-36-38(33)35-25-23-31-3/h19-22,29,31,33H,4-18,23-26H2,1-3H3/p+1