2-[4,6-dimethyl-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridin-5-yl]ethanoic acid

Systemtic Name: 2-[4,6-dimethyl-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridin-5-yl]ethanoic acid Openeye Name: 2-[4,6-dimethyl-1-(3-pyridylmethyl)pyrazolo[3,4-b]pyridin-5-yl]acetic acid CAS Name: 2-[4,6-dimethyl-1-(3-pyridinylmethyl)-5-pyrazolo[3,4-b]pyridinyl]acetic acid IUPAC Name: 2-[4,6-dimethyl-1-(pyridin-3-ylmethyl)pyrazolo[3,4-b]pyridin-5-yl]acetic acid Traditional Name: 2-[4,6-dimethyl-1-(3-pyridylmethyl)pyrazolo[3,4-b]pyridin-5-yl]acetic acid Formula: C16H16N4O2 MolecularWeight: 296.32384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=NN(C2=NC(=C1CC(=O)O)C)CC3=CN=CC=C3

Isomeric SMILES

CC1=C2C=NN(C2=NC(=C1CC(=O)O)C)CC3=CN=CC=C3

InChI

InChI=1S/C16H16N4O2/c1-10-13(6-15(21)22)11(2)19-16-14(10)8-18-20(16)9-12-4-3-5-17-7-12/h3-5,7-8H,6,9H2,1-2H3,(H,21,22)