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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CCN(C)CC(=O)O

Isomeric SMILES

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CCN(C)CC(=O)O

InChI

InChI=1S/C14H22N6O4/c1-3-4-7-24-13-17-11(15)10-12(18-13)20(14(23)16-10)6-5-19(2)8-9(21)22/h3-8H2,1-2H3,(H,16,23)(H,21,22)(H2,15,17,18)