[3-[1-(2-azanyl-6-chloranyl-purin-9-yl)-3-azido-propan-2-yl]oxy-2,4-dimethyl-pentan-3-yl]phosphonic acid

Systemtic Name: [3-[1-(2-azanyl-6-chloranyl-purin-9-yl)-3-azido-propan-2-yl]oxy-2,4-dimethyl-pentan-3-yl]phosphonic acid Openeye Name: [1-[1-[(2-amino-6-chloro-purin-9-yl)methyl]-2-azido-ethoxy]-1-isopropyl-2-methyl-propyl]phosphonic acid CAS Name: [3-[1-(2-amino-6-chloro-9-purinyl)-3-azidopropan-2-yl]oxy-2,4-dimethylpentan-3-yl]phosphonic acid IUPAC Name: [3-[1-(2-amino-6-chloropurin-9-yl)-3-azidopropan-2-yl]oxy-2,4-dimethylpentan-3-yl]phosphonic acid Traditional Name: [1-[1-[(2-amino-6-chloro-purin-9-yl)methyl]-2-azido-ethoxy]-1-isopropyl-2-methyl-propyl]phosphonic acid Formula: C15H24ClN8O4P MolecularWeight: 446.829021

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)C)(OC(CN=[N+]=[N-])CN1C=NC2=C1N=C(N=C2Cl)N)P(=O)(O)O

Isomeric SMILES

CC(C)C(C(C)C)(OC(CN=[N+]=[N-])CN1C=NC2=C1N=C(N=C2Cl)N)P(=O)(O)O

InChI

InChI=1S/C15H24ClN8O4P/c1-8(2)15(9(3)4,29(25,26)27)28-10(5-20-23-18)6-24-7-19-11-12(16)21-14(17)22-13(11)24/h7-10H,5-6H2,1-4H3,(H2,17,21,22)(H2,25,26,27)