1-(3-chloranyl-2-methyl-phenyl)-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid CAS Name: 1-(3-chloro-2-methylphenyl)-3,6-dimethyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 1-(3-chloro-2-methylphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-4-carboxylic acid Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Formula: C16H14ClN3O2 MolecularWeight: 315.75426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C3=C(C(=CC=C3)Cl)C)C)C(=C1)C(=O)O

Isomeric SMILES

CC1=NC2=C(C(=NN2C3=C(C(=CC=C3)Cl)C)C)C(=C1)C(=O)O

InChI

InChI=1S/C16H14ClN3O2/c1-8-7-11(16(21)22)14-10(3)19-20(15(14)18-8)13-6-4-5-12(17)9(13)2/h4-7H,1-3H3,(H,21,22)