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[7-but-2-ynyl-2,6-bis(oxidanylidene)-3H-purin-8-yl] piperazine-1-carboxylate

[7-but-2-ynyl-2,6-bis(oxidanylidene)-3H-purin-8-yl] piperazine-1-carboxylate

Systemtic Name:[7-but-2-ynyl-2,6-bis(oxidanylidene)-3H-purin-8-yl] piperazine-1-carboxylate
Openeye Name:(7-but-2-ynyl-2,6-dioxo-3H-purin-8-yl) piperazine-1-carboxylate
CAS Name:1-piperazinecarboxylic acid (7-but-2-ynyl-2,6-dioxo-3H-purin-8-yl) ester
IUPAC Name:(7-but-2-ynyl-2,6-dioxo-3H-purin-8-yl) piperazine-1-carboxylate
Traditional Name:piperazine-1-carboxylic acid (7-but-2-ynyl-2,6-diketo-3H-purin-8-yl) ester
Formula: C14H16N6O4
MolecularWeight: 332.31464
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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C2=C(NC(=O)NC2=O)N=C1OC(=O)N3CCNCC3


Isomeric SMILES

CC#CCN1C2=C(NC(=O)NC2=O)N=C1OC(=O)N3CCNCC3


InChI

InChI=1S/C14H16N6O4/c1-2-3-6-20-9-10(16-12(22)18-11(9)21)17-13(20)24-14(23)19-7-4-15-5-8-19/h15H,4-8H2,1H3,(H2,16,18,21,22)


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