3-[(2-azanyl-6-chloranyl-purin-9-yl)-oxidanyl-methoxy]propan-1-ol

Systemtic Name: 3-[(2-azanyl-6-chloranyl-purin-9-yl)-oxidanyl-methoxy]propan-1-ol Openeye Name: 3-[(2-amino-6-chloro-purin-9-yl)-hydroxy-methoxy]propan-1-ol CAS Name: 3-[(2-amino-6-chloro-9-purinyl)-hydroxymethoxy]-1-propanol IUPAC Name: 3-[(2-amino-6-chloropurin-9-yl)-hydroxymethoxy]propan-1-ol Traditional Name: 3-[(2-amino-6-chloro-purin-9-yl)-hydroxy-methoxy]propan-1-ol Formula: C9H12ClN5O3 MolecularWeight: 273.67628

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1C(O)OCCCO)N=C(N=C2Cl)N

Isomeric SMILES

C1=NC2=C(N1C(O)OCCCO)N=C(N=C2Cl)N

InChI

InChI=1S/C9H12ClN5O3/c10-6-5-7(14-8(11)13-6)15(4-12-5)9(17)18-3-1-2-16/h4,9,16-17H,1-3H2,(H2,11,13,14)