2-azanyl-1-[3,4-bis(oxidanyl)butyl]-7H-purin-6-one

Systemtic Name: 2-azanyl-1-[3,4-bis(oxidanyl)butyl]-7H-purin-6-one Openeye Name: 2-amino-1-(3,4-dihydroxybutyl)-7H-purin-6-one CAS Name: 2-amino-1-(3,4-dihydroxybutyl)-7H-purin-6-one IUPAC Name: 2-amino-1-(3,4-dihydroxybutyl)-7H-purin-6-one Traditional Name: 2-amino-1-(3,4-dihydroxybutyl)-7H-purin-6-one Formula: C9H13N5O3 MolecularWeight: 239.23122

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=O)N(C(=N2)N)CCC(CO)O

Isomeric SMILES

C1=NC2=C(N1)C(=O)N(C(=N2)N)CCC(CO)O

InChI

InChI=1S/C9H13N5O3/c10-9-13-7-6(11-4-12-7)8(17)14(9)2-1-5(16)3-15/h4-5,15-16H,1-3H2,(H2,10,13)(H,11,12)