dimethyl-[2-[[2-[(2-octadecoxyphenyl)methyl]-4-oxidanylidene-pentoxy]-oxidanyl-phosphoryl]oxyethyl]azanium

Systemtic Name: dimethyl-[2-[[2-[(2-octadecoxyphenyl)methyl]-4-oxidanylidene-pentoxy]-oxidanyl-phosphoryl]oxyethyl]azanium Openeye Name: 2-[hydroxy-[2-[(2-octadecoxyphenyl)methyl]-4-oxo-pentoxy]phosphoryl]oxyethyl-dimethyl-ammonium CAS Name: 2-[hydroxy-[2-[(2-octadecoxyphenyl)methyl]-4-oxopentoxy]phosphoryl]oxyethyl-dimethylammonium IUPAC Name: 2-[hydroxy-[2-[(2-octadecoxyphenyl)methyl]-4-oxopentoxy]phosphoryl]oxyethyl-dimethylazanium Traditional Name: 2-[hydroxy-[4-keto-2-(2-stearyloxybenzyl)pentoxy]phosphoryl]oxyethyl-dimethyl-ammonium Formula: C34H63NO6P+ MolecularWeight: 612.840881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=CC=C1CC(CC(=O)C)COP(=O)(O)OCC[NH+](C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=CC=C1CC(CC(=O)C)COP(=O)(O)OCC[NH+](C)C

InChI

InChI=1S/C34H62NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-26-39-34-24-21-20-23-33(34)29-32(28-31(2)36)30-41-42(37,38)40-27-25-35(3)4/h20-21,23-24,32H,5-19,22,25-30H2,1-4H3,(H,37,38)/p+1