4-[(2,3-dimethylphenyl)amino]-1-ethyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid

Systemtic Name: 4-[(2,3-dimethylphenyl)amino]-1-ethyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid Openeye Name: 4-(2,3-dimethylanilino)-1-ethyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid CAS Name: 4-(2,3-dimethylanilino)-1-ethyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 4-(2,3-dimethylanilino)-1-ethylpyrazolo[3,4-b]pyridine-5-carboxylic acid Traditional Name: 4-(2,3-dimethylanilino)-1-ethyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC=C(C(=C2C=N1)NC3=CC=CC(=C3C)C)C(=O)O

Isomeric SMILES

CCN1C2=NC=C(C(=C2C=N1)NC3=CC=CC(=C3C)C)C(=O)O

InChI

InChI=1S/C17H18N4O2/c1-4-21-16-12(9-19-21)15(13(8-18-16)17(22)23)20-14-7-5-6-10(2)11(14)3/h5-9H,4H2,1-3H3,(H,18,20)(H,22,23)