5-isoquinolin-2-ium-2-yl-6-oxidanylidene-2-phenyl-1H-pyrimidin-4-olate

Systemtic Name: 5-isoquinolin-2-ium-2-yl-6-oxidanylidene-2-phenyl-1H-pyrimidin-4-olate Openeye Name: 5-isoquinolin-2-ium-2-yl-6-oxo-2-phenyl-1H-pyrimidin-4-olate CAS Name: 5-(2-isoquinolin-2-iumyl)-6-oxo-2-phenyl-1H-pyrimidin-4-olate IUPAC Name: 5-isoquinolin-2-ium-2-yl-6-oxo-2-phenyl-1H-pyrimidin-4-olate Traditional Name: 5-isoquinolin-2-ium-2-yl-6-keto-2-phenyl-1H-pyrimidin-4-olate Formula: C19H13N3O2 MolecularWeight: 315.32542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(C(=O)N2)[N+]3=CC4=CC=CC=C4C=C3)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C(=O)N2)[N+]3=CC4=CC=CC=C4C=C3)[O-]

InChI

InChI=1S/C19H13N3O2/c23-18-16(22-11-10-13-6-4-5-9-15(13)12-22)19(24)21-17(20-18)14-7-2-1-3-8-14/h1-12H,(H-,20,21,23,24)