(E)-[2,6-bis(oxidanylidene)-1-phenyl-4-pyridin-1-ium-1-yl-pyrimidin-5-ylidene]methanolate

Systemtic Name: (E)-[2,6-bis(oxidanylidene)-1-phenyl-4-pyridin-1-ium-1-yl-pyrimidin-5-ylidene]methanolate Openeye Name: (E)-(2,6-dioxo-1-phenyl-4-pyridin-1-ium-1-yl-pyrimidin-5-ylidene)methanolate CAS Name: (E)-[2,6-dioxo-1-phenyl-4-(1-pyridin-1-iumyl)-5-pyrimidinylidene]methanolate IUPAC Name: (E)-(2,6-dioxo-1-phenyl-4-pyridin-1-ium-1-ylpyrimidin-5-ylidene)methanolate Traditional Name: (E)-(2,6-diketo-1-phenyl-4-pyridin-1-ium-1-yl-pyrimidin-5-ylidene)methanolate Formula: C16H11N3O3 MolecularWeight: 293.27684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=C[O-])C(=NC2=O)[N+]3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)/C(=C/[O-])/C(=NC2=O)[N+]3=CC=CC=C3

InChI

InChI=1S/C16H11N3O3/c20-11-13-14(18-9-5-2-6-10-18)17-16(22)19(15(13)21)12-7-3-1-4-8-12/h1-11H