4-(3-methoxy-4-oxidanyl-phenyl)carbonyl-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-6-one

Systemtic Name: 4-(3-methoxy-4-oxidanyl-phenyl)carbonyl-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-6-one Openeye Name: 4-(4-hydroxy-3-methoxy-benzoyl)-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-6-one CAS Name: 4-[(4-hydroxy-3-methoxyphenyl)-oxomethyl]-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-6-one IUPAC Name: 4-(4-hydroxy-3-methoxybenzoyl)-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-6-one Traditional Name: 4-vanilloyl-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-6-one Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)C2CC(=O)N=C3C2=CNN3)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)C2CC(=O)N=C3C2=CNN3)O

InChI

InChI=1S/C14H13N3O4/c1-21-11-4-7(2-3-10(11)18)13(20)8-5-12(19)16-14-9(8)6-15-17-14/h2-4,6,8,18H,5H2,1H3,(H2,15,16,17,19)