3,6-bis(oxidanylidene)-2-phenyl-4-pyridin-3-yl-1,4,5,7-tetrahydropyrazolo[3,4-b]pyridine-5-carbonitrile

Systemtic Name: 3,6-bis(oxidanylidene)-2-phenyl-4-pyridin-3-yl-1,4,5,7-tetrahydropyrazolo[3,4-b]pyridine-5-carbonitrile Openeye Name: 3,6-dioxo-2-phenyl-4-(3-pyridyl)-1,4,5,7-tetrahydropyrazolo[3,4-b]pyridine-5-carbonitrile CAS Name: 3,6-dioxo-2-phenyl-4-(3-pyridinyl)-1,4,5,7-tetrahydropyrazolo[3,4-b]pyridine-5-carbonitrile IUPAC Name: 3,6-dioxo-2-phenyl-4-pyridin-3-yl-1,4,5,7-tetrahydropyrazolo[3,4-b]pyridine-5-carbonitrile Traditional Name: 3,6-diketo-2-phenyl-4-(3-pyridyl)-1,4,5,7-tetrahydropyrazolo[3,4-b]pyridine-5-carbonitrile Formula: C18H13N5O2 MolecularWeight: 331.32812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=C(N2)NC(=O)C(C3C4=CN=CC=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=C(N2)NC(=O)C(C3C4=CN=CC=C4)C#N

InChI

InChI=1S/C18H13N5O2/c19-9-13-14(11-5-4-8-20-10-11)15-16(21-17(13)24)22-23(18(15)25)12-6-2-1-3-7-12/h1-8,10,13-14,22H,(H,21,24)