1-[(2S)-butan-2-yl]-6-cyclopropyl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: 1-[(2S)-butan-2-yl]-6-cyclopropyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: 6-cyclopropyl-1-[(1S)-1-methylpropyl]pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-[(2S)-butan-2-yl]-6-cyclopropyl-4-pyrazolo[3,4-b]pyridinecarboxylate IUPAC Name: 1-[(2S)-butan-2-yl]-6-cyclopropylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 6-cyclopropyl-1-[(1S)-1-methylpropyl]pyrazolo[3,4-b]pyridine-4-carboxylate Formula: C14H16N3O2- MolecularWeight: 258.29574

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(C=N1)C(=CC(=N2)C3CC3)C(=O)[O-]

Isomeric SMILES

CC[C@H](C)N1C2=C(C=N1)C(=CC(=N2)C3CC3)C(=O)[O-]

InChI

InChI=1S/C14H17N3O2/c1-3-8(2)17-13-11(7-15-17)10(14(18)19)6-12(16-13)9-4-5-9/h6-9H,3-5H2,1-2H3,(H,18,19)/p-1/t8-/m0/s1