3-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]propyl-bromanyloxy-phosphinic acid

Systemtic Name: 3-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methoxy]propyl-bromanyloxy-phosphinic acid Openeye Name: 3-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]propyl-bromooxy-phosphinic acid CAS Name: 3-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]propyl-bromooxyphosphinic acid IUPAC Name: 3-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]propyl-bromooxyphosphinic acid Traditional Name: 3-[(2-amino-6-keto-3H-purin-9-yl)methoxy]propyl-bromooxy-phosphinic acid Formula: C9H13BrN5O5P MolecularWeight: 382.107781

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1COCCCP(=O)(O)OBr)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1COCCCP(=O)(O)OBr)NC(=NC2=O)N

InChI

InChI=1S/C9H13BrN5O5P/c10-20-21(17,18)3-1-2-19-5-15-4-12-6-7(15)13-9(11)14-8(6)16/h4H,1-3,5H2,(H,17,18)(H3,11,13,14,16)