1-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid

Systemtic Name: 1-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Openeye Name: 1-[2-(cyclopentylamino)-2-oxo-ethyl]-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid CAS Name: 1-[2-(cyclopentylamino)-2-oxoethyl]-3,6-dimethyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 1-[2-(cyclopentylamino)-2-oxoethyl]-3,6-dimethylpyrazolo[3,4-b]pyridine-4-carboxylic acid Traditional Name: 1-[2-(cyclopentylamino)-2-keto-ethyl]-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2CC(=O)NC3CCCC3)C)C(=C1)C(=O)O

Isomeric SMILES

CC1=NC2=C(C(=NN2CC(=O)NC3CCCC3)C)C(=C1)C(=O)O

InChI

InChI=1S/C16H20N4O3/c1-9-7-12(16(22)23)14-10(2)19-20(15(14)17-9)8-13(21)18-11-5-3-4-6-11/h7,11H,3-6,8H2,1-2H3,(H,18,21)(H,22,23)