dimagnesium [(2R,3S,5R)-5-(2-azanidyl-6-oxidanylidene-3H-purin-9-yl)-3-oxidanyl-oxolan-2-yl]methanolate dichloride

Systemtic Name: dimagnesium [(2R,3S,5R)-5-(2-azanidyl-6-oxidanylidene-3H-purin-9-yl)-3-oxidanyl-oxolan-2-yl]methanolate dichloride Openeye Name: dimagnesium [(2R,3S,5R)-5-(2-azanidyl-6-oxo-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methanolate dichloride CAS Name: dimagnesium [(2R,3S,5R)-5-(2-azanidyl-6-oxo-3H-purin-9-yl)-3-hydroxy-2-oxolanyl]methanolate dichloride IUPAC Name: dimagnesium [(2R,3S,5R)-5-(2-azanidyl-6-oxo-3H-purin-9-yl)-3-hydroxyoxolan-2-yl]methanolate dichloride Traditional Name: dimagnesium [(2R,3S,5R)-5-(2-amidyl-6-keto-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methanolate dichloride Formula: C10H11Cl2Mg2N5O4 MolecularWeight: 384.74144

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2NC(=NC3=O)[NH-])C[O-])O.[Mg+2].[Mg+2].[Cl-].[Cl-]

Isomeric SMILES

C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC(=NC3=O)[NH-])C[O-])O.[Mg+2].[Mg+2].[Cl-].[Cl-]

InChI

InChI=1S/C10H12N5O4.2ClH.2Mg/c11-10-13-8-7(9(18)14-10)12-3-15(8)6-1-4(17)5(2-16)19-6;;;;/h3-6,17H,1-2H2,(H3,11,13,14,18);2*1H;;/q-1;;;2*+2/p-3/t4-,5+,6+;;;;/m0..../s1