(6-azanyl-1-oxidanylidene-6H-purin-1-ium-7-yl)methyl 2,2-dimethylpropanoate

Systemtic Name: (6-azanyl-1-oxidanylidene-6H-purin-1-ium-7-yl)methyl 2,2-dimethylpropanoate Openeye Name: (6-amino-1-oxo-6H-purin-1-ium-7-yl)methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid (6-amino-1-oxo-6H-purin-1-ium-7-yl)methyl ester IUPAC Name: (6-amino-1-oxo-6H-purin-1-ium-7-yl)methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid (6-amino-1-keto-6H-purin-1-ium-7-yl)methyl ester Formula: C11H16N5O3+ MolecularWeight: 266.27644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCN1C=NC2=C1C([N+](=O)C=N2)N

Isomeric SMILES

CC(C)(C)C(=O)OCN1C=NC2=C1C([N+](=O)C=N2)N

InChI

InChI=1S/C11H16N5O3/c1-11(2,3)10(17)19-6-15-4-13-9-7(15)8(12)16(18)5-14-9/h4-5,8H,6,12H2,1-3H3/q+1