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

Systemtic Name: 3-(2-butyl-3,4-dimethyl-6-oxidanylidene-pyrazolo[3,4-b]pyridin-7-yl)propanoic acid Openeye Name: 3-(2-butyl-3,4-dimethyl-6-oxo-pyrazolo[3,4-b]pyridin-7-yl)propanoic acid CAS Name: 3-(2-butyl-3,4-dimethyl-6-oxo-7-pyrazolo[3,4-b]pyridinyl)propanoic acid IUPAC Name: 3-(2-butyl-3,4-dimethyl-6-oxopyrazolo[3,4-b]pyridin-7-yl)propanoic acid Traditional Name: 3-(2-butyl-6-keto-3,4-dimethyl-pyrazolo[3,4-b]pyridin-7-yl)propionic acid Formula: C15H21N3O3 MolecularWeight: 291.34554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C2C(=CC(=O)N(C2=N1)CCC(=O)O)C)C

Isomeric SMILES

CCCCN1C(=C2C(=CC(=O)N(C2=N1)CCC(=O)O)C)C

InChI

InChI=1S/C15H21N3O3/c1-4-5-7-18-11(3)14-10(2)9-12(19)17(15(14)16-18)8-6-13(20)21/h9H,4-8H2,1-3H3,(H,20,21)