1-[(4-chlorophenyl)methyl]-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid

Systemtic Name: 1-[(4-chlorophenyl)methyl]-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Openeye Name: 1-[(4-chlorophenyl)methyl]-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid CAS Name: 1-[(4-chlorophenyl)methyl]-6-cyclopropyl-3-methyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 1-[(4-chlorophenyl)methyl]-6-cyclopropyl-3-methylpyrazolo[3,4-b]pyridine-4-carboxylic acid Traditional Name: 1-(4-chlorobenzyl)-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid Formula: C18H16ClN3O2 MolecularWeight: 341.79154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)O)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)O)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H16ClN3O2/c1-10-16-14(18(23)24)8-15(12-4-5-12)20-17(16)22(21-10)9-11-2-6-13(19)7-3-11/h2-3,6-8,12H,4-5,9H2,1H3,(H,23,24)