6-tert-butyl-1-(3-chlorophenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid

Systemtic Name: 6-tert-butyl-1-(3-chlorophenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Openeye Name: 6-tert-butyl-1-(3-chlorophenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid CAS Name: 6-tert-butyl-1-(3-chlorophenyl)-3-methyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 6-tert-butyl-1-(3-chlorophenyl)-3-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid Traditional Name: 6-tert-butyl-1-(3-chlorophenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Formula: C18H18ClN3O2 MolecularWeight: 343.80742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C(C)(C)C)C(=O)O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C(C)(C)C)C(=O)O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H18ClN3O2/c1-10-15-13(17(23)24)9-14(18(2,3)4)20-16(15)22(21-10)12-7-5-6-11(19)8-12/h5-9H,1-4H3,(H,23,24)