2-[1-[6-(methylamino)purin-9-yl]-2-oxidanylidene-ethoxy]-3-oxidanyl-propanal

Systemtic Name: 2-[1-[6-(methylamino)purin-9-yl]-2-oxidanylidene-ethoxy]-3-oxidanyl-propanal Openeye Name: 3-hydroxy-2-[1-[6-(methylamino)purin-9-yl]-2-oxo-ethoxy]propanal CAS Name: 3-hydroxy-2-[1-[6-(methylamino)-9-purinyl]-2-oxoethoxy]propanal IUPAC Name: 3-hydroxy-2-[1-[6-(methylamino)purin-9-yl]-2-oxoethoxy]propanal Traditional Name: 3-hydroxy-2-[2-keto-1-[6-(methylamino)purin-9-yl]ethoxy]propionaldehyde Formula: C11H13N5O4 MolecularWeight: 279.25202

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=NC2=C1N=CN2C(C=O)OC(CO)C=O

Isomeric SMILES

CNC1=NC=NC2=C1N=CN2C(C=O)OC(CO)C=O

InChI

InChI=1S/C11H13N5O4/c1-12-10-9-11(14-5-13-10)16(6-15-9)8(4-19)20-7(2-17)3-18/h2,4-8,18H,3H2,1H3,(H,12,13,14)