4-(2-azanylpurin-9-yl)oxybutane-1,2-diol

Systemtic Name: 4-(2-azanylpurin-9-yl)oxybutane-1,2-diol Openeye Name: 4-(2-aminopurin-9-yl)oxybutane-1,2-diol CAS Name: 4-[(2-amino-9-purinyl)oxy]butane-1,2-diol IUPAC Name: 4-(2-aminopurin-9-yl)oxybutane-1,2-diol Traditional Name: 4-(2-aminopurin-9-yl)oxybutane-1,2-diol Formula: C9H13N5O3 MolecularWeight: 239.23122

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=NC(=N1)N)N(C=N2)OCCC(CO)O

Isomeric SMILES

C1=C2C(=NC(=N1)N)N(C=N2)OCCC(CO)O

InChI

InChI=1S/C9H13N5O3/c10-9-11-3-7-8(13-9)14(5-12-7)17-2-1-6(16)4-15/h3,5-6,15-16H,1-2,4H2,(H2,10,11,13)