3-azanyl-2-pyridin-2-ylcarbonyl-1H-pyrazole-4,5,5-tricarbonitrile

Systemtic Name: 3-azanyl-2-pyridin-2-ylcarbonyl-1H-pyrazole-4,5,5-tricarbonitrile Openeye Name: 3-amino-2-(pyridine-2-carbonyl)-1H-pyrazole-4,5,5-tricarbonitrile CAS Name: 3-amino-2-[oxo(2-pyridinyl)methyl]-1H-pyrazole-4,5,5-tricarbonitrile IUPAC Name: 3-amino-2-(pyridine-2-carbonyl)-1H-pyrazole-4,5,5-tricarbonitrile Traditional Name: 5-amino-1-picolinoyl-3-pyrazoline-3,3,4-tricarbonitrile Formula: C12H7N7O MolecularWeight: 265.23028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(=O)N2C(=C(C(N2)(C#N)C#N)C#N)N

Isomeric SMILES

C1=CC=NC(=C1)C(=O)N2C(=C(C(N2)(C#N)C#N)C#N)N

InChI

InChI=1S/C12H7N7O/c13-5-8-10(16)19(18-12(8,6-14)7-15)11(20)9-3-1-2-4-17-9/h1-4,18H,16H2