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

Systemtic Name: methyl 4-(6-oxidanylidene-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-4-yl)benzoate Openeye Name: methyl 4-(6-oxo-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-4-yl)benzoate CAS Name: 4-(6-oxo-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-4-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(6-oxo-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-4-yl)benzoate Traditional Name: 4-(6-keto-1,2,4,5-tetrahydropyrazolo[3,4-b]pyridin-4-yl)benzoic acid methyl ester Formula: C14H13N3O3 MolecularWeight: 271.27132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O3/c1-20-14(19)9-4-2-8(3-5-9)10-6-12(18)16-13-11(10)7-15-17-13/h2-5,7,10H,6H2,1H3,(H2,15,16,17,18)