2-(3-nitrophenyl)-[1,3]oxazolo[3,2-a]pyrimidin-4-ium

Systemtic Name: 2-(3-nitrophenyl)-[1,3]oxazolo[3,2-a]pyrimidin-4-ium Openeye Name: 2-(3-nitrophenyl)oxazolo[3,2-a]pyrimidin-4-ium CAS Name: 2-(3-nitrophenyl)oxazolo[3,2-a]pyrimidin-4-ium IUPAC Name: 2-(3-nitrophenyl)-[1,3]oxazolo[3,2-a]pyrimidin-4-ium Traditional Name: 2-(3-nitrophenyl)oxazolo[3,2-a]pyrimidin-4-ium Formula: C12H8N3O3+ MolecularWeight: 242.21022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=C[N+]3=CC=CN=C3O2

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=C[N+]3=CC=CN=C3O2

InChI

InChI=1S/C12H8N3O3/c16-15(17)10-4-1-3-9(7-10)11-8-14-6-2-5-13-12(14)18-11/h1-8H/q+1