6-chloranyl-9-[[1-[di(propan-2-yloxy)phosphorylmethoxy]cyclopropyl]methyl]purin-2-amine

Systemtic Name: 6-chloranyl-9-[[1-[di(propan-2-yloxy)phosphorylmethoxy]cyclopropyl]methyl]purin-2-amine Openeye Name: 6-chloro-9-[[1-(diisopropoxyphosphorylmethoxy)cyclopropyl]methyl]purin-2-amine CAS Name: 6-chloro-9-[[1-[di(propan-2-yloxy)phosphorylmethoxy]cyclopropyl]methyl]-2-purinamine IUPAC Name: 6-chloro-9-[[1-[di(propan-2-yloxy)phosphorylmethoxy]cyclopropyl]methyl]purin-2-amine Traditional Name: [6-chloro-9-[[1-(diisopropoxyphosphorylmethoxy)cyclopropyl]methyl]purin-2-yl]amine Formula: C16H25ClN5O4P MolecularWeight: 417.827561

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(COC1(CC1)CN2C=NC3=C2N=C(N=C3Cl)N)OC(C)C

Isomeric SMILES

CC(C)OP(=O)(COC1(CC1)CN2C=NC3=C2N=C(N=C3Cl)N)OC(C)C

InChI

InChI=1S/C16H25ClN5O4P/c1-10(2)25-27(23,26-11(3)4)9-24-16(5-6-16)7-22-8-19-12-13(17)20-15(18)21-14(12)22/h8,10-11H,5-7,9H2,1-4H3,(H2,18,20,21)