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

Systemtic Name: [5-(2-azanyl-8-bromanyl-6-oxidanylidene-3H-purin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [5-(2-amino-8-bromo-6-oxo-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [5-(2-amino-8-bromo-6-oxo-3H-purin-9-yl)-3-hydroxy-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [5-(2-amino-8-bromo-6-oxo-3H-purin-9-yl)-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [5-(2-amino-8-bromo-6-keto-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate Formula: C10H13BrN5O7P MolecularWeight: 426.117281

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C3=C(C(=O)N=C(N3)N)N=C2Br)COP(=O)(O)O)O

Isomeric SMILES

C1C(C(OC1N2C3=C(C(=O)N=C(N3)N)N=C2Br)COP(=O)(O)O)O

InChI

InChI=1S/C10H13BrN5O7P/c11-9-13-6-7(14-10(12)15-8(6)18)16(9)5-1-3(17)4(23-5)2-22-24(19,20)21/h3-5,17H,1-2H2,(H2,19,20,21)(H3,12,14,15,18)