2-azanyl-9-[(2S,4S)-2-(diethoxyphosphorylmethoxy)-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(2S,4S)-2-(diethoxyphosphorylmethoxy)-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[(2S,4S)-2-(diethoxyphosphorylmethoxy)-4-hydroxy-tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[(2S,4S)-2-(diethoxyphosphorylmethoxy)-4-hydroxy-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(2S,4S)-2-(diethoxyphosphorylmethoxy)-4-hydroxyoxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[(2S,4S)-2-(diethoxyphosphorylmethoxy)-4-hydroxy-tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C14H22N5O7P MolecularWeight: 403.327541

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(COC1(CC(CO1)O)N2C=NC3=C2NC(=NC3=O)N)OCC

Isomeric SMILES

CCOP(=O)(CO[C@@]1(C[C@@H](CO1)O)N2C=NC3=C2NC(=NC3=O)N)OCC

InChI

InChI=1S/C14H22N5O7P/c1-3-25-27(22,26-4-2)8-24-14(5-9(20)6-23-14)19-7-16-10-11(19)17-13(15)18-12(10)21/h7,9,20H,3-6,8H2,1-2H3,(H3,15,17,18,21)/t9-,14-/m0/s1