[3,4-bis(oxidanyl)-6-oxidanylidene-2-phosphonooxy-henicosyl]-trimethyl-azanium

Systemtic Name: [3,4-bis(oxidanyl)-6-oxidanylidene-2-phosphonooxy-henicosyl]-trimethyl-azanium Openeye Name: (3,4-dihydroxy-6-oxo-2-phosphonooxy-henicosyl)-trimethyl-ammonium CAS Name: (3,4-dihydroxy-6-oxo-2-phosphonooxyheneicosyl)-trimethylammonium IUPAC Name: (3,4-dihydroxy-6-oxo-2-phosphonooxyhenicosyl)-trimethylazanium Traditional Name: (3,4-dihydroxy-6-keto-2-phosphonooxy-heneicosyl)-trimethyl-ammonium Formula: C24H51NO7P+ MolecularWeight: 496.638001

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)CC(C(C(C[N+](C)(C)C)OP(=O)(O)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)CC(C(C(C[N+](C)(C)C)OP(=O)(O)O)O)O

InChI

InChI=1S/C24H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(26)19-22(27)24(28)23(20-25(2,3)4)32-33(29,30)31/h22-24,27-28H,5-20H2,1-4H3,(H-,29,30,31)/p+1