[(2S)-1-[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethoxy]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]ethoxy]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy]-1-methyl-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy]-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-[2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethoxy]-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-[2-[(2-amino-6-keto-3H-purin-9-yl)methoxy]ethoxy]-2-keto-1-methyl-ethyl]ammonium Formula: C11H17N6O4+ MolecularWeight: 297.29048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCCOCN1C=NC2=C1NC(=NC2=O)N)[NH3+]

Isomeric SMILES

C[C@@H](C(=O)OCCOCN1C=NC2=C1NC(=NC2=O)N)[NH3+]

InChI

InChI=1S/C11H16N6O4/c1-6(12)10(19)21-3-2-20-5-17-4-14-7-8(17)15-11(13)16-9(7)18/h4,6H,2-3,5,12H2,1H3,(H3,13,15,16,18)/p+1/t6-/m0/s1