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

Systemtic Name: 1-(2-cyanoethyl)-6-(2-methoxyphenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: 1-(2-cyanoethyl)-6-(2-methoxyphenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-(2-cyanoethyl)-6-(2-methoxyphenyl)-3-methyl-4-pyrazolo[3,4-b]pyridinecarboxylate IUPAC Name: 1-(2-cyanoethyl)-6-(2-methoxyphenyl)-3-methylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-(2-cyanoethyl)-6-(2-methoxyphenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate Formula: C18H15N4O3- MolecularWeight: 335.3367

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3OC)C(=O)[O-])CCC#N

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3OC)C(=O)[O-])CCC#N

InChI

InChI=1S/C18H16N4O3/c1-11-16-13(18(23)24)10-14(12-6-3-4-7-15(12)25-2)20-17(16)22(21-11)9-5-8-19/h3-4,6-7,10H,5,9H2,1-2H3,(H,23,24)/p-1