1-heptan-4-yl-4,6-dimethyl-pyrazolo[3,4-b]pyridin-3-olate

Systemtic Name: 1-heptan-4-yl-4,6-dimethyl-pyrazolo[3,4-b]pyridin-3-olate Openeye Name: 4,6-dimethyl-1-(1-propylbutyl)pyrazolo[3,4-b]pyridin-3-olate CAS Name: 1-heptan-4-yl-4,6-dimethyl-3-pyrazolo[3,4-b]pyridinolate IUPAC Name: 1-heptan-4-yl-4,6-dimethylpyrazolo[3,4-b]pyridin-3-olate Traditional Name: 4,6-dimethyl-1-(1-propylbutyl)pyrazolo[3,4-b]pyridin-3-olate Formula: C15H22N3O- MolecularWeight: 260.35468

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)N1C2=C(C(=CC(=N2)C)C)C(=N1)[O-]

Isomeric SMILES

CCCC(CCC)N1C2=C(C(=CC(=N2)C)C)C(=N1)[O-]

InChI

InChI=1S/C15H23N3O/c1-5-7-12(8-6-2)18-14-13(15(19)17-18)10(3)9-11(4)16-14/h9,12H,5-8H2,1-4H3,(H,17,19)/p-1