3-[[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]-ethanoyl-amino]propyl ethanoate

Systemtic Name: 3-[[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]-ethanoyl-amino]propyl ethanoate Openeye Name: 3-[acetyl-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]propyl acetate CAS Name: acetic acid 3-[acetyl-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]propyl ester IUPAC Name: 3-[acetyl-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]propyl acetate Traditional Name: acetic acid 3-[acetyl-(2,6-diketo-1,3-dimethyl-7H-purin-8-yl)amino]propyl ester Formula: C14H19N5O5 MolecularWeight: 337.33116

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CCCOC(=O)C)C1=NC2=C(N1)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CC(=O)N(CCCOC(=O)C)C1=NC2=C(N1)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C14H19N5O5/c1-8(20)19(6-5-7-24-9(2)21)13-15-10-11(16-13)17(3)14(23)18(4)12(10)22/h5-7H2,1-4H3,(H,15,16)