6-methyl-2-(4-nitrophenyl)-1H-pyrazolo[3,4-d]pyrimidin-3-one

Systemtic Name: 6-methyl-2-(4-nitrophenyl)-1H-pyrazolo[3,4-d]pyrimidin-3-one Openeye Name: 6-methyl-2-(4-nitrophenyl)-1H-pyrazolo[3,4-d]pyrimidin-3-one CAS Name: 6-methyl-2-(4-nitrophenyl)-1H-pyrazolo[3,4-d]pyrimidin-3-one IUPAC Name: 6-methyl-2-(4-nitrophenyl)-1H-pyrazolo[3,4-d]pyrimidin-3-one Traditional Name: 6-methyl-2-(4-nitrophenyl)-1H-pyrazolo[3,4-d]pyrimidin-3-one Formula: C12H9N5O3 MolecularWeight: 271.23156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2C(=N1)NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C2C(=N1)NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H9N5O3/c1-7-13-6-10-11(14-7)15-16(12(10)18)8-2-4-9(5-3-8)17(19)20/h2-6H,1H3,(H,13,14,15)