4-(furan-2-yl)-3-methyl-6-(2-oxidanylidenepropoxy)-1-phenyl-pyrazolo[3,4-b]pyridine-5-carbonitrile

Systemtic Name: 4-(furan-2-yl)-3-methyl-6-(2-oxidanylidenepropoxy)-1-phenyl-pyrazolo[3,4-b]pyridine-5-carbonitrile Openeye Name: 6-acetonyloxy-4-(2-furyl)-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carbonitrile CAS Name: 4-(2-furanyl)-3-methyl-6-(2-oxopropoxy)-1-phenyl-5-pyrazolo[3,4-b]pyridinecarbonitrile IUPAC Name: 4-(furan-2-yl)-3-methyl-6-(2-oxopropoxy)-1-phenylpyrazolo[3,4-b]pyridine-5-carbonitrile Traditional Name: 6-acetonyloxy-4-(2-furyl)-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carbonitrile Formula: C21H16N4O3 MolecularWeight: 372.37674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=C(C(=N2)OCC(=O)C)C#N)C3=CC=CO3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C(=C(C(=N2)OCC(=O)C)C#N)C3=CC=CO3)C4=CC=CC=C4

InChI

InChI=1S/C21H16N4O3/c1-13(26)12-28-21-16(11-22)19(17-9-6-10-27-17)18-14(2)24-25(20(18)23-21)15-7-4-3-5-8-15/h3-10H,12H2,1-2H3