[1-[(2-azanylpurin-9-yl)methyl]-2,2-dimethyl-cyclopropyl]oxymethylphosphonic acid

Systemtic Name: [1-[(2-azanylpurin-9-yl)methyl]-2,2-dimethyl-cyclopropyl]oxymethylphosphonic acid Openeye Name: [1-[(2-aminopurin-9-yl)methyl]-2,2-dimethyl-cyclopropoxy]methylphosphonic acid CAS Name: [1-[(2-amino-9-purinyl)methyl]-2,2-dimethylcyclopropyl]oxymethylphosphonic acid IUPAC Name: [1-[(2-aminopurin-9-yl)methyl]-2,2-dimethylcyclopropyl]oxymethylphosphonic acid Traditional Name: [1-[(2-aminopurin-9-yl)methyl]-2,2-dimethyl-cyclopropoxy]methylphosphonic acid Formula: C12H18N5O4P MolecularWeight: 327.276181

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1(CN2C=NC3=CN=C(N=C32)N)OCP(=O)(O)O)C

Isomeric SMILES

CC1(CC1(CN2C=NC3=CN=C(N=C32)N)OCP(=O)(O)O)C

InChI

InChI=1S/C12H18N5O4P/c1-11(2)4-12(11,21-7-22(18,19)20)5-17-6-15-8-3-14-10(13)16-9(8)17/h3,6H,4-5,7H2,1-2H3,(H2,13,14,16)(H2,18,19,20)