8-piperazin-4-ium-1-yl-3,7-dihydropurin-6-one

Systemtic Name: 8-piperazin-4-ium-1-yl-3,7-dihydropurin-6-one Openeye Name: 8-piperazin-4-ium-1-yl-3,7-dihydropurin-6-one CAS Name: 8-(1-piperazin-4-iumyl)-3,7-dihydropurin-6-one IUPAC Name: 8-piperazin-4-ium-1-yl-3,7-dihydropurin-6-one Traditional Name: 8-piperazin-4-ium-1-yl-3,7-dihydropurin-6-one Formula: C9H13N6O+ MolecularWeight: 221.23912

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC3=C(N2)C(=O)N=CN3

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC3=C(N2)C(=O)N=CN3

InChI

InChI=1S/C9H12N6O/c16-8-6-7(11-5-12-8)14-9(13-6)15-3-1-10-2-4-15/h5,10H,1-4H2,(H2,11,12,13,14,16)/p+1