4-(2-azanyl-6-oxidanylidene-3H-purin-7-yl)butanal

Systemtic Name: 4-(2-azanyl-6-oxidanylidene-3H-purin-7-yl)butanal Openeye Name: 4-(2-amino-6-oxo-3H-purin-7-yl)butanal CAS Name: 4-(2-amino-6-oxo-3H-purin-7-yl)butanal IUPAC Name: 4-(2-amino-6-oxo-3H-purin-7-yl)butanal Traditional Name: 4-(2-amino-6-keto-3H-purin-7-yl)butyraldehyde Formula: C9H11N5O2 MolecularWeight: 221.21594

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CCCC=O)C(=O)N=C(N2)N

Isomeric SMILES

C1=NC2=C(N1CCCC=O)C(=O)N=C(N2)N

InChI

InChI=1S/C9H11N5O2/c10-9-12-7-6(8(16)13-9)14(5-11-7)3-1-2-4-15/h4-5H,1-3H2,(H3,10,12,13,16)