2-azanyl-9-[5-(diethoxyphosphorylmethoxy)-4-ethenyl-3-oxidanyl-oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[5-(diethoxyphosphorylmethoxy)-4-ethenyl-3-oxidanyl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[5-(diethoxyphosphorylmethoxy)-3-hydroxy-4-vinyl-tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[5-(diethoxyphosphorylmethoxy)-4-ethenyl-3-hydroxy-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[5-(diethoxyphosphorylmethoxy)-4-ethenyl-3-hydroxyoxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[5-(diethoxyphosphorylmethoxy)-3-hydroxy-4-vinyl-tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C16H24N5O7P MolecularWeight: 429.364821

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(COC1C(C(C(O1)N2C=NC3=C2NC(=NC3=O)N)O)C=C)OCC

Isomeric SMILES

CCOP(=O)(COC1C(C(C(O1)N2C=NC3=C2NC(=NC3=O)N)O)C=C)OCC

InChI

InChI=1S/C16H24N5O7P/c1-4-9-11(22)14(21-7-18-10-12(21)19-16(17)20-13(10)23)28-15(9)25-8-29(24,26-5-2)27-6-3/h4,7,9,11,14-15,22H,1,5-6,8H2,2-3H3,(H3,17,19,20,23)