1-(6-aminopurin-9-yl)-3-[bis(2-hydroxyethyl)amino]propan-2-ol

Systemtic Name: 1-(6-aminopurin-9-yl)-3-[bis(2-hydroxyethyl)amino]propan-2-ol Openeye Name: 1-(6-aminopurin-9-yl)-3-[bis(2-hydroxyethyl)amino]propan-2-ol CAS Name: 1-(6-aminopurin-9-yl)-3-[bis(2-hydroxyethyl)amino]-2-propanol IUPAC Name: 1-(6-aminopurin-9-yl)-3-[bis(2-hydroxyethyl)amino]propan-2-ol Traditional Name: 1-adenin-9-yl-3-[bis(2-hydroxyethyl)amino]propan-2-ol Formula: C12H20N6O3 MolecularWeight: 296.3256

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2CC(CN(CCO)CCO)O

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2CC(CN(CCO)CCO)O

InChI

InChI=1S/C12H20N6O3/c13-11-10-12(15-7-14-11)18(8-16-10)6-9(21)5-17(1-3-19)2-4-20/h7-9,19-21H,1-6H2,(H2,13,14,15)