3-[[[(2S)-2-(hexanoylamino)-3-oxidanyl-decyl]amino]-oxidanyl-phosphoryl]oxypropyl-trimethyl-azanium

Systemtic Name: 3-[[[(2S)-2-(hexanoylamino)-3-oxidanyl-decyl]amino]-oxidanyl-phosphoryl]oxypropyl-trimethyl-azanium Openeye Name: 3-[[[(2S)-2-(hexanoylamino)-3-hydroxy-decyl]amino]-hydroxy-phosphoryl]oxypropyl-trimethyl-ammonium CAS Name: 3-[hydroxy-[[(2S)-3-hydroxy-2-(1-oxohexylamino)decyl]amino]phosphoryl]oxypropyl-trimethylammonium IUPAC Name: 3-[[[(2S)-2-(hexanoylamino)-3-hydroxydecyl]amino]-hydroxyphosphoryl]oxypropyl-trimethylazanium Traditional Name: 3-[[[(2S)-2-(caproylamino)-3-hydroxy-decyl]amino]-hydroxy-phosphoryl]oxypropyl-trimethyl-ammonium Formula: C22H49N3O5P+ MolecularWeight: 466.615321

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C(CNP(=O)(O)OCCC[N+](C)(C)C)NC(=O)CCCCC)O

Isomeric SMILES

CCCCCCCC([C@H](CNP(=O)(O)OCCC[N+](C)(C)C)NC(=O)CCCCC)O

InChI

InChI=1S/C22H48N3O5P/c1-6-8-10-11-13-15-21(26)20(24-22(27)16-12-9-7-2)19-23-31(28,29)30-18-14-17-25(3,4)5/h20-21,26H,6-19H2,1-5H3,(H2-,23,24,27,28,29)/p+1/t20-,21?/m0/s1