[1-[(2-azanyl-6-ethoxy-purin-9-yl)methyl]cyclopropyl]oxymethylphosphonic acid

Systemtic Name: [1-[(2-azanyl-6-ethoxy-purin-9-yl)methyl]cyclopropyl]oxymethylphosphonic acid Openeye Name: [1-[(2-amino-6-ethoxy-purin-9-yl)methyl]cyclopropoxy]methylphosphonic acid CAS Name: [1-[(2-amino-6-ethoxy-9-purinyl)methyl]cyclopropyl]oxymethylphosphonic acid IUPAC Name: [1-[(2-amino-6-ethoxypurin-9-yl)methyl]cyclopropyl]oxymethylphosphonic acid Traditional Name: [1-[(2-amino-6-ethoxy-purin-9-yl)methyl]cyclopropoxy]methylphosphonic acid Formula: C12H18N5O5P MolecularWeight: 343.275581

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC2=C1N=CN2CC3(CC3)OCP(=O)(O)O)N

Isomeric SMILES

CCOC1=NC(=NC2=C1N=CN2CC3(CC3)OCP(=O)(O)O)N

InChI

InChI=1S/C12H18N5O5P/c1-2-21-10-8-9(15-11(13)16-10)17(6-14-8)5-12(3-4-12)22-7-23(18,19)20/h6H,2-5,7H2,1H3,(H2,13,15,16)(H2,18,19,20)