1-(2-nitrophenyl)-5-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-(2-nitrophenyl)-5-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(2-nitrophenyl)-5-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(2-nitrophenyl)-5-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 1-(2-nitrophenyl)-5-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(2-nitrophenyl)-5-[4-(pyrrolidine-1-carbonyl)benzyl]pyrazolo[3,4-d]pyrimidin-4-one Formula: C23H20N6O4 MolecularWeight: 444.4427

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5[N+](=O)[O-]

InChI

InChI=1S/C23H20N6O4/c30-22(26-11-3-4-12-26)17-9-7-16(8-10-17)14-27-15-24-21-18(23(27)31)13-25-28(21)19-5-1-2-6-20(19)29(32)33/h1-2,5-10,13,15H,3-4,11-12,14H2