3-[[2-[(4-dodecoxyphenyl)methyl]-4-oxidanylidene-heptoxy]-oxidanyl-phosphoryl]oxypropyl-trimethyl-azanium

Systemtic Name: 3-[[2-[(4-dodecoxyphenyl)methyl]-4-oxidanylidene-heptoxy]-oxidanyl-phosphoryl]oxypropyl-trimethyl-azanium Openeye Name: 3-[[2-[(4-dodecoxyphenyl)methyl]-4-oxo-heptoxy]-hydroxy-phosphoryl]oxypropyl-trimethyl-ammonium CAS Name: 3-[[2-[(4-dodecoxyphenyl)methyl]-4-oxoheptoxy]-hydroxyphosphoryl]oxypropyl-trimethylammonium IUPAC Name: 3-[[2-[(4-dodecoxyphenyl)methyl]-4-oxoheptoxy]-hydroxyphosphoryl]oxypropyl-trimethylazanium Traditional Name: 3-[hydroxy-[4-keto-2-(4-lauryloxybenzyl)heptoxy]phosphoryl]oxypropyl-trimethyl-ammonium Formula: C32H59NO6P+ MolecularWeight: 584.787721

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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