disodium 1-[2-azanyl-6-(dimethylamino)purin-9-yl]-3-(phosphonatomethoxy)propan-2-ol

Systemtic Name: disodium 1-[2-azanyl-6-(dimethylamino)purin-9-yl]-3-(phosphonatomethoxy)propan-2-ol Openeye Name: disodium 1-[2-amino-6-(dimethylamino)purin-9-yl]-3-(phosphonatomethoxy)propan-2-ol CAS Name: disodium 1-[2-amino-6-(dimethylamino)-9-purinyl]-3-(phosphonatomethoxy)-2-propanol IUPAC Name: disodium 1-[2-amino-6-(dimethylamino)purin-9-yl]-3-(phosphonatomethoxy)propan-2-ol Traditional Name: disodium 1-[2-amino-6-(dimethylamino)purin-9-yl]-3-(phosphonatomethoxy)propan-2-ol Formula: C11H17N6Na2O5P MolecularWeight: 390.243181

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC2=C1N=CN2CC(COCP(=O)([O-])[O-])O)N.[Na+].[Na+]

Isomeric SMILES

CN(C)C1=NC(=NC2=C1N=CN2CC(COCP(=O)([O-])[O-])O)N.[Na+].[Na+]

InChI

InChI=1S/C11H19N6O5P.2Na/c1-16(2)9-8-10(15-11(12)14-9)17(5-13-8)3-7(18)4-22-6-23(19,20)21;;/h5,7,18H,3-4,6H2,1-2H3,(H2,12,14,15)(H2,19,20,21);;/q;2*+1/p-2