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

Systemtic Name: 2-[2-(6-azanyl-2-butoxy-8-oxidanylidene-7H-purin-9-yl)ethylamino]ethanoic acid Openeye Name: 2-[2-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)ethylamino]acetic acid CAS Name: 2-[2-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)ethylamino]acetic acid IUPAC Name: 2-[2-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)ethylamino]acetic acid Traditional Name: 2-[2-(6-amino-2-butoxy-8-keto-7H-purin-9-yl)ethylamino]acetic acid Formula: C13H20N6O4 MolecularWeight: 324.3357

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N6O4/c1-2-3-6-23-12-17-10(14)9-11(18-12)19(13(22)16-9)5-4-15-7-8(20)21/h15H,2-7H2,1H3,(H,16,22)(H,20,21)(H2,14,17,18)