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

Systemtic Name: 2-[[2-[3-(4-dodecoxyphenyl)propyl]-4-oxidanylidene-heptoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[2-[3-(4-dodecoxyphenyl)propyl]-4-oxo-heptoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[2-[3-(4-dodecoxyphenyl)propyl]-4-oxoheptoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[2-[3-(4-dodecoxyphenyl)propyl]-4-oxoheptoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[hydroxy-[4-keto-2-[3-(4-lauryloxyphenyl)propyl]heptoxy]phosphoryl]oxyethyl-trimethyl-ammonium Formula: C33H61NO6P+ MolecularWeight: 598.814301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H60NO6P/c1-6-8-9-10-11-12-13-14-15-16-26-38-33-23-21-30(22-24-33)19-17-20-31(28-32(35)18-7-2)29-40-41(36,37)39-27-25-34(3,4)5/h21-24,31H,6-20,25-29H2,1-5H3/p+1