methyl 2-[2-[(6-azanyl-2-butoxy-8-oxidanylidene-7H-purin-9-yl)methyl]morpholin-4-yl]ethanoate

Systemtic Name: methyl 2-[2-[(6-azanyl-2-butoxy-8-oxidanylidene-7H-purin-9-yl)methyl]morpholin-4-yl]ethanoate Openeye Name: methyl 2-[2-[(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)methyl]morpholin-4-yl]acetate CAS Name: 2-[2-[(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)methyl]-4-morpholinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)methyl]morpholin-4-yl]acetate Traditional Name: 2-[2-[(6-amino-2-butoxy-8-keto-7H-purin-9-yl)methyl]morpholino]acetic acid methyl ester Formula: C17H26N6O5 MolecularWeight: 394.42554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CC3CN(CCO3)CC(=O)OC

Isomeric SMILES

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CC3CN(CCO3)CC(=O)OC

InChI

InChI=1S/C17H26N6O5/c1-3-4-6-28-16-20-14(18)13-15(21-16)23(17(25)19-13)9-11-8-22(5-7-27-11)10-12(24)26-2/h11H,3-10H2,1-2H3,(H,19,25)(H2,18,20,21)