3-[4,6-dimethyl-1-(3-methylbutyl)pyrazolo[3,4-b]pyridin-5-yl]propanoic acid

Systemtic Name: 3-[4,6-dimethyl-1-(3-methylbutyl)pyrazolo[3,4-b]pyridin-5-yl]propanoic acid Openeye Name: 3-(1-isopentyl-4,6-dimethyl-pyrazolo[3,4-b]pyridin-5-yl)propanoic acid CAS Name: 3-[4,6-dimethyl-1-(3-methylbutyl)-5-pyrazolo[3,4-b]pyridinyl]propanoic acid IUPAC Name: 3-[4,6-dimethyl-1-(3-methylbutyl)pyrazolo[3,4-b]pyridin-5-yl]propanoic acid Traditional Name: 3-(1-isoamyl-4,6-dimethyl-pyrazolo[3,4-b]pyridin-5-yl)propionic acid Formula: C16H23N3O2 MolecularWeight: 289.37272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=NN(C2=NC(=C1CCC(=O)O)C)CCC(C)C

Isomeric SMILES

CC1=C2C=NN(C2=NC(=C1CCC(=O)O)C)CCC(C)C

InChI

InChI=1S/C16H23N3O2/c1-10(2)7-8-19-16-14(9-17-19)11(3)13(12(4)18-16)5-6-15(20)21/h9-10H,5-8H2,1-4H3,(H,20,21)