4-(6-aminopurin-9-yl)butylphosphonic acid

Systemtic Name: 4-(6-aminopurin-9-yl)butylphosphonic acid Openeye Name: 4-(6-aminopurin-9-yl)butylphosphonic acid CAS Name: 4-(6-aminopurin-9-yl)butylphosphonic acid IUPAC Name: 4-(6-aminopurin-9-yl)butylphosphonic acid Traditional Name: 4-adenin-9-ylbutylphosphonic acid Formula: C9H14N5O3P MolecularWeight: 271.212921

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2CCCCP(=O)(O)O

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2CCCCP(=O)(O)O

InChI

InChI=1S/C9H14N5O3P/c10-8-7-9(12-5-11-8)14(6-13-7)3-1-2-4-18(15,16)17/h5-6H,1-4H2,(H2,10,11,12)(H2,15,16,17)