3-nitro-N-(6-oxidanylidene-1,5-diphenyl-pyrazolo[3,4-d]pyrimidin-4-yl)benzamide

Systemtic Name: 3-nitro-N-(6-oxidanylidene-1,5-diphenyl-pyrazolo[3,4-d]pyrimidin-4-yl)benzamide Openeye Name: 3-nitro-N-(6-oxo-1,5-diphenyl-pyrazolo[3,4-d]pyrimidin-4-yl)benzamide CAS Name: 3-nitro-N-(6-oxo-1,5-diphenyl-4-pyrazolo[3,4-d]pyrimidinyl)benzamide IUPAC Name: 3-nitro-N-(6-oxo-1,5-diphenylpyrazolo[3,4-d]pyrimidin-4-yl)benzamide Traditional Name: N-(6-keto-1,5-diphenyl-pyrazolo[3,4-d]pyrimidin-4-yl)-3-nitro-benzamide Formula: C24H16N6O4 MolecularWeight: 452.42164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C3C=NN(C3=NC2=O)C4=CC=CC=C4)NC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C3C=NN(C3=NC2=O)C4=CC=CC=C4)NC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C24H16N6O4/c31-23(16-8-7-13-19(14-16)30(33)34)26-21-20-15-25-29(18-11-5-2-6-12-18)22(20)27-24(32)28(21)17-9-3-1-4-10-17/h1-15H,(H,26,31)