6-chloranyl-9-[[1-(2,4-dimethyl-3-phosphonato-pentan-3-yl)oxy-2-methyl-cyclopropyl]methyl]purin-2-amine

Systemtic Name: 6-chloranyl-9-[[1-(2,4-dimethyl-3-phosphonato-pentan-3-yl)oxy-2-methyl-cyclopropyl]methyl]purin-2-amine Openeye Name: 6-chloro-9-[[1-(1-isopropyl-2-methyl-1-phosphonato-propoxy)-2-methyl-cyclopropyl]methyl]purin-2-amine CAS Name: 6-chloro-9-[[1-(2,4-dimethyl-3-phosphonatopentan-3-yl)oxy-2-methylcyclopropyl]methyl]-2-purinamine IUPAC Name: 6-chloro-9-[[1-(2,4-dimethyl-3-phosphonatopentan-3-yl)oxy-2-methylcyclopropyl]methyl]purin-2-amine Traditional Name: [6-chloro-9-[[1-(1-isopropyl-2-methyl-1-phosphonato-propoxy)-2-methyl-cyclopropyl]methyl]purin-2-yl]amine Formula: C17H25ClN5O4P-2 MolecularWeight: 429.838261

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1(CN2C=NC3=C2N=C(N=C3Cl)N)OC(C(C)C)(C(C)C)P(=O)([O-])[O-]

Isomeric SMILES

CC1CC1(CN2C=NC3=C2N=C(N=C3Cl)N)OC(C(C)C)(C(C)C)P(=O)([O-])[O-]

InChI

InChI=1S/C17H27ClN5O4P/c1-9(2)17(10(3)4,28(24,25)26)27-16(6-11(16)5)7-23-8-20-12-13(18)21-15(19)22-14(12)23/h8-11H,6-7H2,1-5H3,(H2,19,21,22)(H2,24,25,26)/p-2