2-azanyl-9-(4-oxidanyl-2-oxidanylidene-butyl)-3H-purin-6-one

Systemtic Name: 2-azanyl-9-(4-oxidanyl-2-oxidanylidene-butyl)-3H-purin-6-one Openeye Name: 2-amino-9-(4-hydroxy-2-oxo-butyl)-3H-purin-6-one CAS Name: 2-amino-9-(4-hydroxy-2-oxobutyl)-3H-purin-6-one IUPAC Name: 2-amino-9-(4-hydroxy-2-oxobutyl)-3H-purin-6-one Traditional Name: 2-amino-9-(4-hydroxy-2-keto-butyl)-3H-purin-6-one Formula: C9H11N5O3 MolecularWeight: 237.21534

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CC(=O)CCO)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1CC(=O)CCO)NC(=NC2=O)N

InChI

InChI=1S/C9H11N5O3/c10-9-12-7-6(8(17)13-9)11-4-14(7)3-5(16)1-2-15/h4,15H,1-3H2,(H3,10,12,13,17)