6,7-dimethyl-4-oxidanylidene-2-phenyl-1H-imidazo[1,5-a]pyrimidin-5-ium-8-carboxylate

Systemtic Name: 6,7-dimethyl-4-oxidanylidene-2-phenyl-1H-imidazo[1,5-a]pyrimidin-5-ium-8-carboxylate Openeye Name: 6,7-dimethyl-4-oxo-2-phenyl-1H-imidazo[1,5-a]pyrimidin-5-ium-8-carboxylate CAS Name: 6,7-dimethyl-4-oxo-2-phenyl-1H-imidazo[1,5-a]pyrimidin-5-ium-8-carboxylate IUPAC Name: 6,7-dimethyl-4-oxo-2-phenyl-1H-imidazo[1,5-a]pyrimidin-5-ium-8-carboxylate Traditional Name: 4-keto-6,7-dimethyl-2-phenyl-1H-imidazo[1,5-a]pyrimidin-5-ium-8-carboxylate Formula: C15H13N3O3 MolecularWeight: 283.28202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+]2C(=O)C=C(NC2=C(N1C)C(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=[N+]2C(=O)C=C(NC2=C(N1C)C(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C15H13N3O3/c1-9-17(2)13(15(20)21)14-16-11(8-12(19)18(9)14)10-6-4-3-5-7-10/h3-8H,1-2H3,(H-,16,19,20,21)