(2R)-2-(3,4-dimethyl-6-oxidanylidene-1-propyl-pyrazolo[3,4-b]pyridin-7-yl)propanoic acid

Systemtic Name: (2R)-2-(3,4-dimethyl-6-oxidanylidene-1-propyl-pyrazolo[3,4-b]pyridin-7-yl)propanoic acid Openeye Name: (2R)-2-(3,4-dimethyl-6-oxo-1-propyl-pyrazolo[3,4-b]pyridin-7-yl)propanoic acid CAS Name: (2R)-2-(3,4-dimethyl-6-oxo-1-propyl-7-pyrazolo[3,4-b]pyridinyl)propanoic acid IUPAC Name: (2R)-2-(3,4-dimethyl-6-oxo-1-propylpyrazolo[3,4-b]pyridin-7-yl)propanoic acid Traditional Name: (2R)-2-(6-keto-3,4-dimethyl-1-propyl-pyrazolo[3,4-b]pyridin-7-yl)propionic acid Formula: C14H19N3O3 MolecularWeight: 277.31896

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=CC(=O)N2C(C)C(=O)O)C)C(=N1)C

Isomeric SMILES

CCCN1C2=C(C(=CC(=O)N2[C@H](C)C(=O)O)C)C(=N1)C

InChI

InChI=1S/C14H19N3O3/c1-5-6-16-13-12(9(3)15-16)8(2)7-11(18)17(13)10(4)14(19)20/h7,10H,5-6H2,1-4H3,(H,19,20)/t10-/m1/s1