4-[2-(cyclohexen-1-yl)ethylamino]-1-methyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid

Systemtic Name: 4-[2-(cyclohexen-1-yl)ethylamino]-1-methyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid Openeye Name: 4-[2-(cyclohexen-1-yl)ethylamino]-1-methyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid CAS Name: 4-[2-(1-cyclohexenyl)ethylamino]-1-methyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 4-[2-(cyclohexen-1-yl)ethylamino]-1-methylpyrazolo[3,4-b]pyridine-5-carboxylic acid Traditional Name: 4-[2-(cyclohexen-1-yl)ethylamino]-1-methyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid Formula: C16H20N4O2 MolecularWeight: 300.3556

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC=C(C(=C2C=N1)NCCC3=CCCCC3)C(=O)O

Isomeric SMILES

CN1C2=NC=C(C(=C2C=N1)NCCC3=CCCCC3)C(=O)O

InChI

InChI=1S/C16H20N4O2/c1-20-15-12(10-19-20)14(13(9-18-15)16(21)22)17-8-7-11-5-3-2-4-6-11/h5,9-10H,2-4,6-8H2,1H3,(H,17,18)(H,21,22)