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1,3,7-tris(prop-2-ynyl)purine-2,6-dione

1,3,7-tris(prop-2-ynyl)purine-2,6-dione

Systemtic Name:1,3,7-tris(prop-2-ynyl)purine-2,6-dione
Openeye Name:1,3,7-tris(prop-2-ynyl)purine-2,6-dione
CAS Name:1,3,7-tris(prop-2-ynyl)purine-2,6-dione
IUPAC Name:1,3,7-tris(prop-2-ynyl)purine-2,6-dione
Traditional Name:1,3,7-tripropargylxanthine
Formula: C14H10N4O2
MolecularWeight: 266.2548
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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C=NC2=C1C(=O)N(C(=O)N2CC#C)CC#C


Isomeric SMILES

C#CCN1C=NC2=C1C(=O)N(C(=O)N2CC#C)CC#C


InChI

InChI=1S/C14H10N4O2/c1-4-7-16-10-15-12-11(16)13(19)18(9-6-3)14(20)17(12)8-5-2/h1-3,10H,7-9H2


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