3-[3-azanyl-5-(3-nitrophenyl)-2H-pyrazolo[3,4-c]pyridazin-4-yl]benzenecarbonitrile

Systemtic Name: 3-[3-azanyl-5-(3-nitrophenyl)-2H-pyrazolo[3,4-c]pyridazin-4-yl]benzenecarbonitrile Openeye Name: 3-[3-amino-5-(3-nitrophenyl)-2H-pyrazolo[3,4-c]pyridazin-4-yl]benzonitrile CAS Name: 3-[3-amino-5-(3-nitrophenyl)-2H-pyrazolo[3,4-c]pyridazin-4-yl]benzonitrile IUPAC Name: 3-[3-amino-5-(3-nitrophenyl)-2H-pyrazolo[3,4-c]pyridazin-4-yl]benzonitrile Traditional Name: 3-[3-amino-5-(3-nitrophenyl)-2H-pyrazolo[3,4-c]pyridazin-4-yl]benzonitrile Formula: C18H11N7O2 MolecularWeight: 357.32564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=C(N=NC3=NNC(=C23)N)C4=CC(=CC=C4)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)C2=C(N=NC3=NNC(=C23)N)C4=CC(=CC=C4)[N+](=O)[O-])C#N

InChI

InChI=1S/C18H11N7O2/c19-9-10-3-1-4-11(7-10)14-15-17(20)22-24-18(15)23-21-16(14)12-5-2-6-13(8-12)25(26)27/h1-8H,(H3,20,22,23,24)