2-methoxy-6-piperazin-1-yl-9-propa-1,2-dienyl-purine

Systemtic Name: 2-methoxy-6-piperazin-1-yl-9-propa-1,2-dienyl-purine Openeye Name: 2-methoxy-6-piperazin-1-yl-9-propa-1,2-dienyl-purine CAS Name: 2-methoxy-6-(1-piperazinyl)-9-propa-1,2-dienylpurine IUPAC Name: 2-methoxy-6-piperazin-1-yl-9-propa-1,2-dienylpurine Traditional Name: 2-methoxy-6-piperazino-9-propa-1,2-dienyl-purine Formula: C13H16N6O MolecularWeight: 272.30574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=C(C(=N1)N3CCNCC3)N=CN2C=C=C

Isomeric SMILES

COC1=NC2=C(C(=N1)N3CCNCC3)N=CN2C=C=C

InChI

InChI=1S/C13H16N6O/c1-3-6-19-9-15-10-11(18-7-4-14-5-8-18)16-13(20-2)17-12(10)19/h6,9,14H,1,4-5,7-8H2,2H3