6-(acetyloxymethyl)-4-chloranyl-1-pentyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid

Systemtic Name: 6-(acetyloxymethyl)-4-chloranyl-1-pentyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid Openeye Name: 6-(acetoxymethyl)-4-chloro-1-pentyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid CAS Name: 6-(acetyloxymethyl)-4-chloro-1-pentyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 6-(acetyloxymethyl)-4-chloro-1-pentylpyrazolo[3,4-b]pyridine-5-carboxylic acid Traditional Name: 6-(acetoxymethyl)-1-amyl-4-chloro-pyrazolo[3,4-b]pyridine-5-carboxylic acid Formula: C15H18ClN3O4 MolecularWeight: 339.77412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=NC(=C(C(=C2C=N1)Cl)C(=O)O)COC(=O)C

Isomeric SMILES

CCCCCN1C2=NC(=C(C(=C2C=N1)Cl)C(=O)O)COC(=O)C

InChI

InChI=1S/C15H18ClN3O4/c1-3-4-5-6-19-14-10(7-17-19)13(16)12(15(21)22)11(18-14)8-23-9(2)20/h7H,3-6,8H2,1-2H3,(H,21,22)