[1-[5-azido-3,4-di(hexanoyloxy)-5-(hydroxymethyl)oxolan-2-yl]-2-oxidanylidene-pyrimidin-4-yl]azanium

Systemtic Name: [1-[5-azido-3,4-di(hexanoyloxy)-5-(hydroxymethyl)oxolan-2-yl]-2-oxidanylidene-pyrimidin-4-yl]azanium Openeye Name: [1-[5-azido-3,4-di(hexanoyloxy)-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-pyrimidin-4-yl]ammonium CAS Name: [1-[5-azido-5-(hydroxymethyl)-3,4-bis(1-oxohexoxy)-2-oxolanyl]-2-oxo-4-pyrimidinyl]ammonium IUPAC Name: [1-[5-azido-3,4-di(hexanoyloxy)-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]azanium Traditional Name: [1-(5-azido-3,4-dicaproyloxy-5-methylol-tetrahydrofuran-2-yl)-2-keto-pyrimidin-4-yl]ammonium Formula: C21H33N6O7+ MolecularWeight: 481.52272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1C(C(OC1N2C=CC(=NC2=O)[NH3+])(CO)N=[N+]=[N-])OC(=O)CCCCC

Isomeric SMILES

CCCCCC(=O)OC1C(C(OC1N2C=CC(=NC2=O)[NH3+])(CO)N=[N+]=[N-])OC(=O)CCCCC

InChI

InChI=1S/C21H32N6O7/c1-3-5-7-9-15(29)32-17-18(33-16(30)10-8-6-4-2)21(13-28,25-26-23)34-19(17)27-12-11-14(22)24-20(27)31/h11-12,17-19,28H,3-10,13H2,1-2H3,(H2,22,24,31)/p+1