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

Systemtic Name: [1-[(2-azanyl-6-chloranyl-purin-9-yl)methyl]-2-methyl-cyclopropyl]oxymethylphosphonic acid Openeye Name: [1-[(2-amino-6-chloro-purin-9-yl)methyl]-2-methyl-cyclopropoxy]methylphosphonic acid CAS Name: [1-[(2-amino-6-chloro-9-purinyl)methyl]-2-methylcyclopropyl]oxymethylphosphonic acid IUPAC Name: [1-[(2-amino-6-chloropurin-9-yl)methyl]-2-methylcyclopropyl]oxymethylphosphonic acid Traditional Name: [1-[(2-amino-6-chloro-purin-9-yl)methyl]-2-methyl-cyclopropoxy]methylphosphonic acid Formula: C11H15ClN5O4P MolecularWeight: 347.694661

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1(CN2C=NC3=C2N=C(N=C3Cl)N)OCP(=O)(O)O

Isomeric SMILES

CC1CC1(CN2C=NC3=C2N=C(N=C3Cl)N)OCP(=O)(O)O

InChI

InChI=1S/C11H15ClN5O4P/c1-6-2-11(6,21-5-22(18,19)20)3-17-4-14-7-8(12)15-10(13)16-9(7)17/h4,6H,2-3,5H2,1H3,(H2,13,15,16)(H2,18,19,20)