3-[7-ethyl-3,4-dimethyl-1-(3-methylphenyl)-6-oxidanylidene-pyrazolo[3,4-b]pyridin-5-yl]propanoic acid

Systemtic Name: 3-[7-ethyl-3,4-dimethyl-1-(3-methylphenyl)-6-oxidanylidene-pyrazolo[3,4-b]pyridin-5-yl]propanoic acid Openeye Name: 3-[7-ethyl-3,4-dimethyl-1-(m-tolyl)-6-oxo-pyrazolo[3,4-b]pyridin-5-yl]propanoic acid CAS Name: 3-[7-ethyl-3,4-dimethyl-1-(3-methylphenyl)-6-oxo-5-pyrazolo[3,4-b]pyridinyl]propanoic acid IUPAC Name: 3-[7-ethyl-3,4-dimethyl-1-(3-methylphenyl)-6-oxopyrazolo[3,4-b]pyridin-5-yl]propanoic acid Traditional Name: 3-[7-ethyl-6-keto-3,4-dimethyl-1-(m-tolyl)pyrazolo[3,4-b]pyridin-5-yl]propionic acid Formula: C20H23N3O3 MolecularWeight: 353.41492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=C(C1=O)CCC(=O)O)C)C(=NN2C3=CC=CC(=C3)C)C

Isomeric SMILES

CCN1C2=C(C(=C(C1=O)CCC(=O)O)C)C(=NN2C3=CC=CC(=C3)C)C

InChI

InChI=1S/C20H23N3O3/c1-5-22-19-18(13(3)16(20(22)26)9-10-17(24)25)14(4)21-23(19)15-8-6-7-12(2)11-15/h6-8,11H,5,9-10H2,1-4H3,(H,24,25)