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1,3-diethyl-8-phenyl-purin-3-ium-2,6-dione

1,3-diethyl-8-phenyl-purin-3-ium-2,6-dione

Systemtic Name:1,3-diethyl-8-phenyl-purin-3-ium-2,6-dione
Openeye Name:1,3-diethyl-8-phenyl-purin-3-ium-2,6-dione
CAS Name:1,3-diethyl-8-phenylpurin-3-ium-2,6-dione
IUPAC Name:1,3-diethyl-8-phenylpurin-3-ium-2,6-dione
Traditional Name:1,3-diethyl-8-phenyl-purin-3-ium-2,6-quinone
Formula: C15H15N4O2+
MolecularWeight: 283.3052
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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=NC(=NC2=[N+](C1=O)CC)C3=CC=CC=C3


Isomeric SMILES

CCN1C(=O)C2=NC(=NC2=[N+](C1=O)CC)C3=CC=CC=C3


InChI

InChI=1S/C15H15N4O2/c1-3-18-13-11(14(20)19(4-2)15(18)21)16-12(17-13)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3/q+1


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