actinium; 2-[3-(2-azanylpurin-9-yl)propyl]propane-1,3-diol

Systemtic Name: actinium; 2-[3-(2-azanylpurin-9-yl)propyl]propane-1,3-diol Openeye Name: actinium; 2-[3-(2-aminopurin-9-yl)propyl]propane-1,3-diol CAS Name: actinium; 2-[3-(2-amino-9-purinyl)propyl]propane-1,3-diol IUPAC Name: actinium; 2-[3-(2-aminopurin-9-yl)propyl]propane-1,3-diol Traditional Name: actinium; 2-[3-(2-aminopurin-9-yl)propyl]propane-1,3-diol Formula: C11H17Ac2N5O2 MolecularWeight: 705.340474

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=NC(=N1)N)N(C=N2)CCCC(CO)CO.[Ac].[Ac]

Isomeric SMILES

C1=C2C(=NC(=N1)N)N(C=N2)CCCC(CO)CO.[Ac].[Ac]

InChI

InChI=1S/C11H17N5O2.2Ac/c12-11-13-4-9-10(15-11)16(7-14-9)3-1-2-8(5-17)6-18;;/h4,7-8,17-18H,1-3,5-6H2,(H2,12,13,15);;