3-phenyl-5-propyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-olate

Systemtic Name: 3-phenyl-5-propyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-olate Openeye Name: 3-phenyl-5-propyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-olate CAS Name: 3-phenyl-5-propyl-2-(trifluoromethyl)-7-pyrazolo[1,5-a]pyrimidinolate IUPAC Name: 3-phenyl-5-propyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-olate Traditional Name: 3-phenyl-5-propyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-olate Formula: C16H13F3N3O- MolecularWeight: 320.28913

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C(=NN2C(=C1)[O-])C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CCCC1=NC2=C(C(=NN2C(=C1)[O-])C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C16H14F3N3O/c1-2-6-11-9-12(23)22-15(20-11)13(10-7-4-3-5-8-10)14(21-22)16(17,18)19/h3-5,7-9,23H,2,6H2,1H3/p-1