4-(4-propan-2-ylphenyl)carbonyl-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-6-one

Systemtic Name: 4-(4-propan-2-ylphenyl)carbonyl-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-6-one Openeye Name: 4-(4-isopropylbenzoyl)-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-6-one CAS Name: 4-[oxo-(4-propan-2-ylphenyl)methyl]-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-6-one IUPAC Name: 4-(4-propan-2-ylbenzoyl)-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-6-one Traditional Name: 4-cumoyl-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-6-one Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)C2CC(=O)N=C3C2=CNN3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)C2CC(=O)N=C3C2=CNN3

InChI

InChI=1S/C16H17N3O2/c1-9(2)10-3-5-11(6-4-10)15(21)12-7-14(20)18-16-13(12)8-17-19-16/h3-6,8-9,12H,7H2,1-2H3,(H2,17,18,19,20)