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dimethyl 2-[5-[6-(methylamino)purin-9-yl]pentyl]propanedioate

dimethyl 2-[5-[6-(methylamino)purin-9-yl]pentyl]propanedioate

Systemtic Name:dimethyl 2-[5-[6-(methylamino)purin-9-yl]pentyl]propanedioate
Openeye Name:dimethyl 2-[5-[6-(methylamino)purin-9-yl]pentyl]propanedioate
CAS Name:2-[5-[6-(methylamino)-9-purinyl]pentyl]propanedioic acid dimethyl ester
IUPAC Name:dimethyl 2-[5-[6-(methylamino)purin-9-yl]pentyl]propanedioate
Traditional Name:2-[5-[6-(methylamino)purin-9-yl]pentyl]malonic acid dimethyl ester
Formula: C16H23N5O4
MolecularWeight: 349.38492
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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=NC2=C1N=CN2CCCCCC(C(=O)OC)C(=O)OC


Isomeric SMILES

CNC1=NC=NC2=C1N=CN2CCCCCC(C(=O)OC)C(=O)OC


InChI

InChI=1S/C16H23N5O4/c1-17-13-12-14(19-9-18-13)21(10-20-12)8-6-4-5-7-11(15(22)24-2)16(23)25-3/h9-11H,4-8H2,1-3H3,(H,17,18,19)


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