methyl 1-(2-cyanoethyl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: methyl 1-(2-cyanoethyl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: methyl 1-(2-cyanoethyl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-(2-cyanoethyl)-3-methyl-6-phenyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-cyanoethyl)-3-methyl-6-phenylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-(2-cyanoethyl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid methyl ester Formula: C18H16N4O2 MolecularWeight: 320.34524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)OC)CCC#N

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)OC)CCC#N

InChI

InChI=1S/C18H16N4O2/c1-12-16-14(18(23)24-2)11-15(13-7-4-3-5-8-13)20-17(16)22(21-12)10-6-9-19/h3-5,7-8,11H,6,10H2,1-2H3