methyl 5-chloranyl-3,6-dimethyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: methyl 5-chloranyl-3,6-dimethyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: methyl 5-chloro-3,6-dimethyl-1-(p-tolylmethyl)pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 5-chloro-3,6-dimethyl-1-[(4-methylphenyl)methyl]-4-pyrazolo[3,4-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-chloro-3,6-dimethyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 5-chloro-3,6-dimethyl-1-(4-methylbenzyl)pyrazolo[3,4-b]pyridine-4-carboxylic acid methyl ester Formula: C18H18ClN3O2 MolecularWeight: 343.80742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=NC(=C(C(=C3C(=N2)C)C(=O)OC)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=NC(=C(C(=C3C(=N2)C)C(=O)OC)Cl)C

InChI

InChI=1S/C18H18ClN3O2/c1-10-5-7-13(8-6-10)9-22-17-14(11(2)21-22)15(18(23)24-4)16(19)12(3)20-17/h5-8H,9H2,1-4H3