1-[(2S)-butan-2-yl]-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid

Systemtic Name: 1-[(2S)-butan-2-yl]-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Openeye Name: 3-methyl-1-[(1S)-1-methylpropyl]-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid CAS Name: 1-[(2S)-butan-2-yl]-3-methyl-6-phenyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 1-[(2S)-butan-2-yl]-3-methyl-6-phenylpyrazolo[3,4-b]pyridine-4-carboxylic acid Traditional Name: 3-methyl-1-[(1S)-1-methylpropyl]-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Formula: C18H19N3O2 MolecularWeight: 309.36236

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(C(=N1)C)C(=CC(=N2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC[C@H](C)N1C2=C(C(=N1)C)C(=CC(=N2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H19N3O2/c1-4-11(2)21-17-16(12(3)20-21)14(18(22)23)10-15(19-17)13-8-6-5-7-9-13/h5-11H,4H2,1-3H3,(H,22,23)/t11-/m0/s1