(5-bromanyl-2-methoxy-phenyl)methyl 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: (5-bromo-2-methoxy-phenyl)methyl 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1,3-dimethyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid (5-bromo-2-methoxyphenyl)methyl ester IUPAC Name: (5-bromo-2-methoxyphenyl)methyl 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid (5-bromo-2-methoxy-benzyl) ester Formula: C17H16BrN3O3 MolecularWeight: 390.23124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C=C12)C(=O)OCC3=C(C=CC(=C3)Br)OC)C

Isomeric SMILES

CC1=NN(C2=NC=C(C=C12)C(=O)OCC3=C(C=CC(=C3)Br)OC)C

InChI

InChI=1S/C17H16BrN3O3/c1-10-14-7-11(8-19-16(14)21(2)20-10)17(22)24-9-12-6-13(18)4-5-15(12)23-3/h4-8H,9H2,1-3H3