2-(phenoxymethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate

Systemtic Name: 2-(phenoxymethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Openeye Name: 2-(phenoxymethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate CAS Name: 2-(phenoxymethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate IUPAC Name: 2-(phenoxymethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Traditional Name: 2-(phenoxymethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-olate Formula: C18H13N4O2- MolecularWeight: 317.32142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=NC(=NN3C(=C2)[O-])COC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=NC(=NN3C(=C2)[O-])COC4=CC=CC=C4

InChI

InChI=1S/C18H14N4O2/c23-17-11-15(13-7-3-1-4-8-13)19-18-20-16(21-22(17)18)12-24-14-9-5-2-6-10-14/h1-11,23H,12H2/p-1