4-azanyl-1-(3-cyanopropyl)-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid

Systemtic Name: 4-azanyl-1-(3-cyanopropyl)-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid Openeye Name: 4-amino-1-(3-cyanopropyl)-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid CAS Name: 4-amino-1-(3-cyanopropyl)-6-methyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 4-amino-1-(3-cyanopropyl)-6-methylpyrazolo[3,4-b]pyridine-5-carboxylic acid Traditional Name: 4-amino-1-(3-cyanopropyl)-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid Formula: C12H13N5O2 MolecularWeight: 259.26392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=NN(C2=N1)CCCC#N)N)C(=O)O

Isomeric SMILES

CC1=C(C(=C2C=NN(C2=N1)CCCC#N)N)C(=O)O

InChI

InChI=1S/C12H13N5O2/c1-7-9(12(18)19)10(14)8-6-15-17(11(8)16-7)5-3-2-4-13/h6H,2-3,5H2,1H3,(H2,14,16)(H,18,19)