[2-azanyl-3-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)propoxy]methylphosphonic acid

Systemtic Name: [2-azanyl-3-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)propoxy]methylphosphonic acid Openeye Name: [2-amino-3-(2-amino-6-oxo-3H-purin-9-yl)propoxy]methylphosphonic acid CAS Name: [2-amino-3-(2-amino-6-oxo-3H-purin-9-yl)propoxy]methylphosphonic acid IUPAC Name: [2-amino-3-(2-amino-6-oxo-3H-purin-9-yl)propoxy]methylphosphonic acid Traditional Name: [2-amino-3-(2-amino-6-keto-3H-purin-9-yl)propoxy]methylphosphonic acid Formula: C9H15N6O5P MolecularWeight: 318.226361

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H15N6O5P/c10-5(2-20-4-21(17,18)19)1-15-3-12-6-7(15)13-9(11)14-8(6)16/h3,5H,1-2,4,10H2,(H2,17,18,19)(H3,11,13,14,16)