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

Systemtic Name: methyl 2-[2-(6-azanyl-2-butoxy-8-oxidanylidene-7H-purin-9-yl)ethylamino]ethanoate Openeye Name: methyl 2-[2-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)ethylamino]acetate CAS Name: 2-[2-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)ethylamino]acetic acid methyl ester IUPAC Name: methyl 2-[2-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)ethylamino]acetate Traditional Name: 2-[2-(6-amino-2-butoxy-8-keto-7H-purin-9-yl)ethylamino]acetic acid methyl ester Formula: C14H22N6O4 MolecularWeight: 338.36228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CCNCC(=O)OC

Isomeric SMILES

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CCNCC(=O)OC

InChI

InChI=1S/C14H22N6O4/c1-3-4-7-24-13-18-11(15)10-12(19-13)20(14(22)17-10)6-5-16-8-9(21)23-2/h16H,3-8H2,1-2H3,(H,17,22)(H2,15,18,19)