methyl 6-(1,3-benzodioxol-5-yl)-1-butyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: methyl 6-(1,3-benzodioxol-5-yl)-1-butyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: methyl 6-(1,3-benzodioxol-5-yl)-1-butyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 6-(1,3-benzodioxol-5-yl)-1-butyl-3-methyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-(1,3-benzodioxol-5-yl)-1-butyl-3-methylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 6-(1,3-benzodioxol-5-yl)-1-butyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid methyl ester Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=N1)C)C(=CC(=N2)C3=CC4=C(C=C3)OCO4)C(=O)OC

Isomeric SMILES

CCCCN1C2=C(C(=N1)C)C(=CC(=N2)C3=CC4=C(C=C3)OCO4)C(=O)OC

InChI

InChI=1S/C20H21N3O4/c1-4-5-8-23-19-18(12(2)22-23)14(20(24)25-3)10-15(21-19)13-6-7-16-17(9-13)27-11-26-16/h6-7,9-10H,4-5,8,11H2,1-3H3