3-[(2-azanyl-6-chloranyl-purin-9-yl)methoxymethoxy]pentan-3-ylphosphonic acid

Systemtic Name: 3-[(2-azanyl-6-chloranyl-purin-9-yl)methoxymethoxy]pentan-3-ylphosphonic acid Openeye Name: [1-[(2-amino-6-chloro-purin-9-yl)methoxymethoxy]-1-ethyl-propyl]phosphonic acid CAS Name: 3-[(2-amino-6-chloro-9-purinyl)methoxymethoxy]pentan-3-ylphosphonic acid IUPAC Name: 3-[(2-amino-6-chloropurin-9-yl)methoxymethoxy]pentan-3-ylphosphonic acid Traditional Name: [1-[(2-amino-6-chloro-purin-9-yl)methoxymethoxy]-1-ethyl-propyl]phosphonic acid Formula: C12H19ClN5O5P MolecularWeight: 379.736521

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(OCOCN1C=NC2=C1N=C(N=C2Cl)N)P(=O)(O)O

Isomeric SMILES

CCC(CC)(OCOCN1C=NC2=C1N=C(N=C2Cl)N)P(=O)(O)O

InChI

InChI=1S/C12H19ClN5O5P/c1-3-12(4-2,24(19,20)21)23-7-22-6-18-5-15-8-9(13)16-11(14)17-10(8)18/h5H,3-4,6-7H2,1-2H3,(H2,14,16,17)(H2,19,20,21)