4-[[2-[(4-dodecoxyphenyl)methyl]-4-oxidanylidene-pentoxy]-oxidanyl-phosphoryl]oxybutyl-ethyl-dimethyl-azanium

Systemtic Name: 4-[[2-[(4-dodecoxyphenyl)methyl]-4-oxidanylidene-pentoxy]-oxidanyl-phosphoryl]oxybutyl-ethyl-dimethyl-azanium Openeye Name: 4-[[2-[(4-dodecoxyphenyl)methyl]-4-oxo-pentoxy]-hydroxy-phosphoryl]oxybutyl-ethyl-dimethyl-ammonium CAS Name: 4-[[2-[(4-dodecoxyphenyl)methyl]-4-oxopentoxy]-hydroxyphosphoryl]oxybutyl-ethyl-dimethylammonium IUPAC Name: 4-[[2-[(4-dodecoxyphenyl)methyl]-4-oxopentoxy]-hydroxyphosphoryl]oxybutyl-ethyl-dimethylazanium Traditional Name: ethyl-[4-[hydroxy-[4-keto-2-(4-lauryloxybenzyl)pentoxy]phosphoryl]oxybutyl]-dimethyl-ammonium Formula: C32H59NO6P+ MolecularWeight: 584.787721

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)CC(CC(=O)C)COP(=O)(O)OCCCC[N+](C)(C)CC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)CC(CC(=O)C)COP(=O)(O)OCCCC[N+](C)(C)CC

InChI

InChI=1S/C32H58NO6P/c1-6-8-9-10-11-12-13-14-15-17-24-37-32-21-19-30(20-22-32)27-31(26-29(3)34)28-39-40(35,36)38-25-18-16-23-33(4,5)7-2/h19-22,31H,6-18,23-28H2,1-5H3/p+1