4-(3-tert-butyl-4,6-dimethyl-pyrazolo[3,4-b]pyridin-1-yl)benzoic acid

Systemtic Name: 4-(3-tert-butyl-4,6-dimethyl-pyrazolo[3,4-b]pyridin-1-yl)benzoic acid Openeye Name: 4-(3-tert-butyl-4,6-dimethyl-pyrazolo[3,4-b]pyridin-1-yl)benzoic acid CAS Name: 4-(3-tert-butyl-4,6-dimethyl-1-pyrazolo[3,4-b]pyridinyl)benzoic acid IUPAC Name: 4-(3-tert-butyl-4,6-dimethylpyrazolo[3,4-b]pyridin-1-yl)benzoic acid Traditional Name: 4-(3-tert-butyl-4,6-dimethyl-pyrazolo[3,4-b]pyridin-1-yl)benzoic acid Formula: C19H21N3O2 MolecularWeight: 323.38894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=NN2C3=CC=C(C=C3)C(=O)O)C(C)(C)C)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=NN2C3=CC=C(C=C3)C(=O)O)C(C)(C)C)C

InChI

InChI=1S/C19H21N3O2/c1-11-10-12(2)20-17-15(11)16(19(3,4)5)21-22(17)14-8-6-13(7-9-14)18(23)24/h6-10H,1-5H3,(H,23,24)