1-(4-fluorophenyl)-5-[(4-nitropyrazol-1-yl)methyl]pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-(4-fluorophenyl)-5-[(4-nitropyrazol-1-yl)methyl]pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(4-fluorophenyl)-5-[(4-nitropyrazol-1-yl)methyl]pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(4-fluorophenyl)-5-[(4-nitro-1-pyrazolyl)methyl]-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 1-(4-fluorophenyl)-5-[(4-nitropyrazol-1-yl)methyl]pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(4-fluorophenyl)-5-[(4-nitropyrazol-1-yl)methyl]pyrazolo[3,4-d]pyrimidin-4-one Formula: C15H10FN7O3 MolecularWeight: 355.283403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C3=C(C=N2)C(=O)N(C=N3)CN4C=C(C=N4)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1N2C3=C(C=N2)C(=O)N(C=N3)CN4C=C(C=N4)[N+](=O)[O-])F

InChI

InChI=1S/C15H10FN7O3/c16-10-1-3-11(4-2-10)22-14-13(6-19-22)15(24)20(8-17-14)9-21-7-12(5-18-21)23(25)26/h1-8H,9H2