6-chloranyl-9-[(E)-4-di(propan-2-yloxy)phosphorylbut-3-enyl]purin-2-amine

Systemtic Name: 6-chloranyl-9-[(E)-4-di(propan-2-yloxy)phosphorylbut-3-enyl]purin-2-amine Openeye Name: 6-chloro-9-[(E)-4-diisopropoxyphosphorylbut-3-enyl]purin-2-amine CAS Name: 6-chloro-9-[(E)-4-di(propan-2-yloxy)phosphorylbut-3-enyl]-2-purinamine IUPAC Name: 6-chloro-9-[(E)-4-di(propan-2-yloxy)phosphorylbut-3-enyl]purin-2-amine Traditional Name: [6-chloro-9-[(E)-4-diisopropoxyphosphorylbut-3-enyl]purin-2-yl]amine Formula: C15H23ClN5O3P MolecularWeight: 387.801581

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(C=CCCN1C=NC2=C1N=C(N=C2Cl)N)OC(C)C

Isomeric SMILES

CC(C)OP(=O)(/C=C/CCN1C=NC2=C1N=C(N=C2Cl)N)OC(C)C

InChI

InChI=1S/C15H23ClN5O3P/c1-10(2)23-25(22,24-11(3)4)8-6-5-7-21-9-18-12-13(16)19-15(17)20-14(12)21/h6,8-11H,5,7H2,1-4H3,(H2,17,19,20)/b8-6+