2-[2,3-bis(1H-imidazol-2-ylcarbonyloxy)propoxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[2,3-bis(1H-imidazol-2-ylcarbonyloxy)propoxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[2,3-bis(1H-imidazole-2-carbonyloxy)propoxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[2,3-bis[1H-imidazol-2-yl(oxo)methoxy]propoxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[2,3-bis(1H-imidazole-2-carbonyloxy)propoxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[2,3-bis(1H-imidazole-2-carbonyloxy)propoxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C16H25N5O8P+ MolecularWeight: 446.372161

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCOP(=O)(O)OCC(COC(=O)C1=NC=CN1)OC(=O)C2=NC=CN2

Isomeric SMILES

C[N+](C)(C)CCOP(=O)(O)OCC(COC(=O)C1=NC=CN1)OC(=O)C2=NC=CN2

InChI

InChI=1S/C16H24N5O8P/c1-21(2,3)8-9-27-30(24,25)28-11-12(29-16(23)14-19-6-7-20-14)10-26-15(22)13-17-4-5-18-13/h4-7,12H,8-11H2,1-3H3,(H2-,17,18,19,20,22,23,24,25)/p+1