2-(5-chloranyl-3,4-dimethyl-6-oxidanylidene-1-propyl-pyrazolo[3,4-b]pyridin-7-yl)ethanoate

Systemtic Name: 2-(5-chloranyl-3,4-dimethyl-6-oxidanylidene-1-propyl-pyrazolo[3,4-b]pyridin-7-yl)ethanoate Openeye Name: 2-(5-chloro-3,4-dimethyl-6-oxo-1-propyl-pyrazolo[3,4-b]pyridin-7-yl)acetate CAS Name: 2-(5-chloro-3,4-dimethyl-6-oxo-1-propyl-7-pyrazolo[3,4-b]pyridinyl)acetate IUPAC Name: 2-(5-chloro-3,4-dimethyl-6-oxo-1-propylpyrazolo[3,4-b]pyridin-7-yl)acetate Traditional Name: 2-(5-chloro-6-keto-3,4-dimethyl-1-propyl-pyrazolo[3,4-b]pyridin-7-yl)acetate Formula: C13H15ClN3O3- MolecularWeight: 296.7295

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=C(C(=O)N2CC(=O)[O-])Cl)C)C(=N1)C

Isomeric SMILES

CCCN1C2=C(C(=C(C(=O)N2CC(=O)[O-])Cl)C)C(=N1)C

InChI

InChI=1S/C13H16ClN3O3/c1-4-5-17-12-10(8(3)15-17)7(2)11(14)13(20)16(12)6-9(18)19/h4-6H2,1-3H3,(H,18,19)/p-1