1-(4-oxidanyl-6-oxidanylidene-2-phenyl-1H-pyrimidin-5-yl)pyridin-1-ium-3-carboxamide

Systemtic Name: 1-(4-oxidanyl-6-oxidanylidene-2-phenyl-1H-pyrimidin-5-yl)pyridin-1-ium-3-carboxamide Openeye Name: 1-(4-hydroxy-6-oxo-2-phenyl-1H-pyrimidin-5-yl)pyridin-1-ium-3-carboxamide CAS Name: 1-(4-hydroxy-6-oxo-2-phenyl-1H-pyrimidin-5-yl)-3-pyridin-1-iumcarboxamide IUPAC Name: 1-(4-hydroxy-6-oxo-2-phenyl-1H-pyrimidin-5-yl)pyridin-1-ium-3-carboxamide Traditional Name: 1-(4-hydroxy-6-keto-2-phenyl-1H-pyrimidin-5-yl)pyridin-1-ium-3-carboxamide Formula: C16H13N4O3+ MolecularWeight: 309.29942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N4O3/c17-13(21)11-7-4-8-20(9-11)12-15(22)18-14(19-16(12)23)10-5-2-1-3-6-10/h1-9H,(H3-,17,18,19,21,22,23)/p+1