2-azanyl-8-bromanyl-9-[(2R,3R,4R,5R)-5-(hydroxymethyl)-3-methoxy-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-8-bromanyl-9-[(2R,3R,4R,5R)-5-(hydroxymethyl)-3-methoxy-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-8-bromo-9-[(2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-8-bromo-9-[(2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-8-bromo-9-[(2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-8-bromo-9-[(2R,3R,4R,5R)-4-hydroxy-3-methoxy-5-methylol-tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C11H14BrN5O5 MolecularWeight: 376.16336

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(OC1N2C3=C(C(=O)N=C(N3)N)N=C2Br)CO)O

Isomeric SMILES

CO[C@@H]1[C@@H]([C@H](O[C@H]1N2C3=C(C(=O)N=C(N3)N)N=C2Br)CO)O

InChI

InChI=1S/C11H14BrN5O5/c1-21-6-5(19)3(2-18)22-9(6)17-7-4(14-10(17)12)8(20)16-11(13)15-7/h3,5-6,9,18-19H,2H2,1H3,(H3,13,15,16,20)/t3-,5-,6-,9-/m1/s1