3-methyl-1-(4-methylphenyl)-6-(trifluoromethyl)pyrazolo[3,4-d]pyrimidin-4-olate

Systemtic Name: 3-methyl-1-(4-methylphenyl)-6-(trifluoromethyl)pyrazolo[3,4-d]pyrimidin-4-olate Openeye Name: 3-methyl-1-(p-tolyl)-6-(trifluoromethyl)pyrazolo[3,4-d]pyrimidin-4-olate CAS Name: 3-methyl-1-(4-methylphenyl)-6-(trifluoromethyl)-4-pyrazolo[3,4-d]pyrimidinolate IUPAC Name: 3-methyl-1-(4-methylphenyl)-6-(trifluoromethyl)pyrazolo[3,4-d]pyrimidin-4-olate Traditional Name: 3-methyl-1-(p-tolyl)-6-(trifluoromethyl)pyrazolo[3,4-d]pyrimidin-4-olate Formula: C14H10F3N4O- MolecularWeight: 307.25061

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C(=N2)C)C(=NC(=N3)C(F)(F)F)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C(=N2)C)C(=NC(=N3)C(F)(F)F)[O-]

InChI

InChI=1S/C14H11F3N4O/c1-7-3-5-9(6-4-7)21-11-10(8(2)20-21)12(22)19-13(18-11)14(15,16)17/h3-6H,1-2H3,(H,18,19,22)/p-1