methyl 4-[1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxybenzoate

Systemtic Name: methyl 4-[1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxybenzoate Openeye Name: methyl 4-[1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxybenzoate CAS Name: 4-[[1-(4-fluorophenyl)-4-pyrazolo[3,4-d]pyrimidinyl]oxy]benzoic acid methyl ester IUPAC Name: methyl 4-[1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxybenzoate Traditional Name: 4-[1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxybenzoic acid methyl ester Formula: C19H13FN4O3 MolecularWeight: 364.329923

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)F

InChI

InChI=1S/C19H13FN4O3/c1-26-19(25)12-2-8-15(9-3-12)27-18-16-10-23-24(17(16)21-11-22-18)14-6-4-13(20)5-7-14/h2-11H,1H3