methyl 4-(3-cyclobutyl-6-oxidanylidene-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-4-yl)benzoate

Systemtic Name: methyl 4-(3-cyclobutyl-6-oxidanylidene-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-4-yl)benzoate Openeye Name: methyl 4-(3-cyclobutyl-6-oxo-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-4-yl)benzoate CAS Name: 4-(3-cyclobutyl-6-oxo-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-4-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(3-cyclobutyl-6-oxo-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-4-yl)benzoate Traditional Name: 4-(3-cyclobutyl-6-keto-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-4-yl)benzoic acid methyl ester Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2CC(=O)N=C3C2=C(NN3)C4CCC4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2CC(=O)N=C3C2=C(NN3)C4CCC4

InChI

InChI=1S/C18H19N3O3/c1-24-18(23)12-7-5-10(6-8-12)13-9-14(22)19-17-15(13)16(20-21-17)11-3-2-4-11/h5-8,11,13H,2-4,9H2,1H3,(H2,19,20,21,22)