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

Systemtic Name: 6-(4-chlorophenyl)-1-(2,4-dinitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-(4-chlorophenyl)-1-(2,4-dinitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(4-chlorophenyl)-1-(2,4-dinitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-(4-chlorophenyl)-1-(2,4-dinitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-(4-chlorophenyl)-1-(2,4-dinitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C17H9ClN6O5 MolecularWeight: 412.74356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=O)C3=CNN(C3=N2)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=O)C3=CNN(C3=N2)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C17H9ClN6O5/c18-10-3-1-9(2-4-10)15-20-16-12(17(25)21-15)8-19-22(16)13-6-5-11(23(26)27)7-14(13)24(28)29/h1-8,19H