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

Systemtic Name: 1-butyl-4-chloranyl-3-methyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid Openeye Name: 1-butyl-4-chloro-3-methyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid CAS Name: 1-butyl-4-chloro-3-methyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 1-butyl-4-chloro-3-methylpyrazolo[3,4-b]pyridine-5-carboxylic acid Traditional Name: 1-butyl-4-chloro-3-methyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid Formula: C12H14ClN3O2 MolecularWeight: 267.71146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14ClN3O2/c1-3-4-5-16-11-9(7(2)15-16)10(13)8(6-14-11)12(17)18/h6H,3-5H2,1-2H3,(H,17,18)