2-[[(3S)-3-methoxy-4-octadecoxy-butyl]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[(3S)-3-methoxy-4-octadecoxy-butyl]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[hydroxy-[(3S)-3-methoxy-4-octadecoxy-butyl]phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[hydroxy-[(3S)-3-methoxy-4-octadecoxybutyl]phosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[hydroxy-[(3S)-3-methoxy-4-octadecoxybutyl]phosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[hydroxy-[(3S)-3-methoxy-4-stearyloxy-butyl]phosphoryl]oxyethyl-trimethyl-ammonium Formula: C28H61NO5P+ MolecularWeight: 522.761401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CCP(=O)(O)OCC[N+](C)(C)C)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC[C@H](CCP(=O)(O)OCC[N+](C)(C)C)OC

InChI

InChI=1S/C28H60NO5P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-33-27-28(32-5)22-26-35(30,31)34-25-23-29(2,3)4/h28H,6-27H2,1-5H3/p+1/t28-/m0/s1