6-chloranyl-9-[[(2S,5S)-5-diethoxyphosphoryloxolan-2-yl]methyl]-3,6-dihydropurin-2-amine

Systemtic Name: 6-chloranyl-9-[[(2S,5S)-5-diethoxyphosphoryloxolan-2-yl]methyl]-3,6-dihydropurin-2-amine Openeye Name: 6-chloro-9-[[(2S,5S)-5-diethoxyphosphoryltetrahydrofuran-2-yl]methyl]-3,6-dihydropurin-2-amine CAS Name: 6-chloro-9-[[(2S,5S)-5-diethoxyphosphoryl-2-oxolanyl]methyl]-3,6-dihydropurin-2-amine IUPAC Name: 6-chloro-9-[[(2S,5S)-5-diethoxyphosphoryloxolan-2-yl]methyl]-3,6-dihydropurin-2-amine Traditional Name: [6-chloro-9-[[(2S,5S)-5-diethoxyphosphoryltetrahydrofuran-2-yl]methyl]-3,6-dihydropurin-2-yl]amine Formula: C14H23ClN5O4P MolecularWeight: 391.790281

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1CCC(O1)CN2C=NC3=C2NC(=NC3Cl)N)OCC

Isomeric SMILES

CCOP(=O)([C@H]1CC[C@H](O1)CN2C=NC3=C2NC(=NC3Cl)N)OCC

InChI

InChI=1S/C14H23ClN5O4P/c1-3-22-25(21,23-4-2)10-6-5-9(24-10)7-20-8-17-11-12(15)18-14(16)19-13(11)20/h8-10,12H,3-7H2,1-2H3,(H3,16,18,19)/t9-,10-,12?/m0/s1