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4-(pyrimidin-1-ium-1-ylamino)isoindole-1,3-dione

4-(pyrimidin-1-ium-1-ylamino)isoindole-1,3-dione

Systemtic Name:4-(pyrimidin-1-ium-1-ylamino)isoindole-1,3-dione
Openeye Name:4-(pyrimidin-1-ium-1-ylamino)isoindoline-1,3-dione
CAS Name:4-(1-pyrimidin-1-iumylamino)isoindole-1,3-dione
IUPAC Name:4-(pyrimidin-1-ium-1-ylamino)isoindole-1,3-dione
Traditional Name:4-(pyrimidin-1-ium-1-ylamino)isoindoline-1,3-quinone
Formula: C12H9N4O2+
MolecularWeight: 241.22546
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)N[N+]3=CC=CN=C3)C(=O)NC2=O


Isomeric SMILES

C1=CC2=C(C(=C1)N[N+]3=CC=CN=C3)C(=O)NC2=O


InChI

InChI=1S/C12H8N4O2/c17-11-8-3-1-4-9(10(8)12(18)14-11)15-16-6-2-5-13-7-16/h1-7H,(H-,14,15,17,18)/p+1


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