1-methyl-4-(2-pyrrol-1-ylethylamino)pyrazolo[3,4-b]pyridine-5-carboxylic acid

Systemtic Name: 1-methyl-4-(2-pyrrol-1-ylethylamino)pyrazolo[3,4-b]pyridine-5-carboxylic acid Openeye Name: 1-methyl-4-(2-pyrrol-1-ylethylamino)pyrazolo[3,4-b]pyridine-5-carboxylic acid CAS Name: 1-methyl-4-[2-(1-pyrrolyl)ethylamino]-5-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 1-methyl-4-(2-pyrrol-1-ylethylamino)pyrazolo[3,4-b]pyridine-5-carboxylic acid Traditional Name: 1-methyl-4-(2-pyrrol-1-ylethylamino)pyrazolo[3,4-b]pyridine-5-carboxylic acid Formula: C14H15N5O2 MolecularWeight: 285.3012

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC=C(C(=C2C=N1)NCCN3C=CC=C3)C(=O)O

Isomeric SMILES

CN1C2=NC=C(C(=C2C=N1)NCCN3C=CC=C3)C(=O)O

InChI

InChI=1S/C14H15N5O2/c1-18-13-10(9-17-18)12(11(8-16-13)14(20)21)15-4-7-19-5-2-3-6-19/h2-3,5-6,8-9H,4,7H2,1H3,(H,15,16)(H,20,21)