[5-(8-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl 2-phenoxyethanoate

Systemtic Name: [5-(8-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl 2-phenoxyethanoate Openeye Name: [5-(8-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl 2-phenoxyacetate CAS Name: 2-phenoxyacetic acid [5-(8-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-2-oxolanyl]methyl ester IUPAC Name: [5-(8-amino-6-oxo-3H-purin-9-yl)-3-hydroxyoxolan-2-yl]methyl 2-phenoxyacetate Traditional Name: 2-phenoxyacetic acid [5-(8-amino-6-keto-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl ester Formula: C18H19N5O6 MolecularWeight: 401.37336

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C3=C(C(=O)N=CN3)N=C2N)COC(=O)COC4=CC=CC=C4)O

Isomeric SMILES

C1C(C(OC1N2C3=C(C(=O)N=CN3)N=C2N)COC(=O)COC4=CC=CC=C4)O

InChI

InChI=1S/C18H19N5O6/c19-18-22-15-16(20-9-21-17(15)26)23(18)13-6-11(24)12(29-13)7-28-14(25)8-27-10-4-2-1-3-5-10/h1-5,9,11-13,24H,6-8H2,(H2,19,22)(H,20,21,26)