(2-azanyl-1-ethanoyl-6-oxidanylidene-7,8-dihydropurin-9-yl)methyl 2,2-dimethylpropanoate; oxetane

Systemtic Name: (2-azanyl-1-ethanoyl-6-oxidanylidene-7,8-dihydropurin-9-yl)methyl 2,2-dimethylpropanoate; oxetane Openeye Name: (1-acetyl-2-amino-6-oxo-7,8-dihydropurin-9-yl)methyl 2,2-dimethylpropanoate; oxetane CAS Name: 2,2-dimethylpropanoic acid (1-acetyl-2-amino-6-oxo-7,8-dihydropurin-9-yl)methyl ester; oxetane IUPAC Name: (1-acetyl-2-amino-6-oxo-7,8-dihydropurin-9-yl)methyl 2,2-dimethylpropanoate; oxetane Traditional Name: 2,2-dimethylpropionic acid (1-acetyl-2-amino-6-keto-7,8-dihydropurin-9-yl)methyl ester; oxetane Formula: C16H25N5O5 MolecularWeight: 367.4002

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(=O)C2=C(N=C1N)N(CN2)COC(=O)C(C)(C)C.C1COC1

Isomeric SMILES

CC(=O)N1C(=O)C2=C(N=C1N)N(CN2)COC(=O)C(C)(C)C.C1COC1

InChI

InChI=1S/C13H19N5O4.C3H6O/c1-7(19)18-10(20)8-9(16-12(18)14)17(5-15-8)6-22-11(21)13(2,3)4;1-2-4-3-1/h15H,5-6H2,1-4H3,(H2,14,16);1-3H2