[3-(6-aminopurin-9-yl)-2-(1-ethoxyethoxy)propoxy]methylphosphonic acid

Systemtic Name: [3-(6-aminopurin-9-yl)-2-(1-ethoxyethoxy)propoxy]methylphosphonic acid Openeye Name: [3-(6-aminopurin-9-yl)-2-(1-ethoxyethoxy)propoxy]methylphosphonic acid CAS Name: [3-(6-aminopurin-9-yl)-2-(1-ethoxyethoxy)propoxy]methylphosphonic acid IUPAC Name: [3-(6-aminopurin-9-yl)-2-(1-ethoxyethoxy)propoxy]methylphosphonic acid Traditional Name: [3-adenin-9-yl-2-(1-ethoxyethoxy)propoxy]methylphosphonic acid Formula: C13H22N5O6P MolecularWeight: 375.317441

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)OC(CN1C=NC2=C1N=CN=C2N)COCP(=O)(O)O

Isomeric SMILES

CCOC(C)OC(CN1C=NC2=C1N=CN=C2N)COCP(=O)(O)O

InChI

InChI=1S/C13H22N5O6P/c1-3-23-9(2)24-10(5-22-8-25(19,20)21)4-18-7-17-11-12(14)15-6-16-13(11)18/h6-7,9-10H,3-5,8H2,1-2H3,(H2,14,15,16)(H2,19,20,21)