azanium [3-azido-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-2-yl]methoxy-octadecoxycarbonyl-phosphinate

Systemtic Name: azanium [3-azido-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-2-yl]methoxy-octadecoxycarbonyl-phosphinate Openeye Name: ammonium [3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-octadecoxycarbonyl-phosphinate CAS Name: ammonium [3-azido-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]methoxy-[octadecoxy(oxo)methyl]phosphinate IUPAC Name: azanium [3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-octadecoxycarbonylphosphinate Traditional Name: ammonium [3-azido-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-stearyloxycarbonyl-phosphinate Formula: C29H53N6O8P MolecularWeight: 644.740281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)P(=O)([O-])OCC1C(CC(O1)N2C=C(C(=O)NC2=O)C)N=[N+]=[N-].[NH4+]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)P(=O)([O-])OCC1C(CC(O1)N2C=C(C(=O)NC2=O)C)N=[N+]=[N-].[NH4+]

InChI

InChI=1S/C29H50N5O8P.H3N/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-40-29(37)43(38,39)41-22-25-24(32-33-30)20-26(42-25)34-21-23(2)27(35)31-28(34)36;/h21,24-26H,3-20,22H2,1-2H3,(H,38,39)(H,31,35,36);1H3