1-butyl-5-chloranyl-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid

Systemtic Name: 1-butyl-5-chloranyl-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Openeye Name: 1-butyl-5-chloro-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid CAS Name: 1-butyl-5-chloro-3,6-dimethyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 1-butyl-5-chloro-3,6-dimethylpyrazolo[3,4-b]pyridine-4-carboxylic acid Traditional Name: 1-butyl-5-chloro-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Formula: C13H16ClN3O2 MolecularWeight: 281.73804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=NC(=C(C(=C2C(=N1)C)C(=O)O)Cl)C

Isomeric SMILES

CCCCN1C2=NC(=C(C(=C2C(=N1)C)C(=O)O)Cl)C

InChI

InChI=1S/C13H16ClN3O2/c1-4-5-6-17-12-9(7(2)16-17)10(13(18)19)11(14)8(3)15-12/h4-6H2,1-3H3,(H,18,19)