propan-2-yl 4-[(3,4-dimethyl-6-oxidanylidene-1-phenyl-pyrazolo[3,4-b]pyridin-7-yl)methyl]benzoate

Systemtic Name: propan-2-yl 4-[(3,4-dimethyl-6-oxidanylidene-1-phenyl-pyrazolo[3,4-b]pyridin-7-yl)methyl]benzoate Openeye Name: isopropyl 4-[(3,4-dimethyl-6-oxo-1-phenyl-pyrazolo[3,4-b]pyridin-7-yl)methyl]benzoate CAS Name: 4-[(3,4-dimethyl-6-oxo-1-phenyl-7-pyrazolo[3,4-b]pyridinyl)methyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[(3,4-dimethyl-6-oxo-1-phenylpyrazolo[3,4-b]pyridin-7-yl)methyl]benzoate Traditional Name: 4-[(6-keto-3,4-dimethyl-1-phenyl-pyrazolo[3,4-b]pyridin-7-yl)methyl]benzoic acid isopropyl ester Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C2=C1C(=NN2C3=CC=CC=C3)C)CC4=CC=C(C=C4)C(=O)OC(C)C

Isomeric SMILES

CC1=CC(=O)N(C2=C1C(=NN2C3=CC=CC=C3)C)CC4=CC=C(C=C4)C(=O)OC(C)C

InChI

InChI=1S/C25H25N3O3/c1-16(2)31-25(30)20-12-10-19(11-13-20)15-27-22(29)14-17(3)23-18(4)26-28(24(23)27)21-8-6-5-7-9-21/h5-14,16H,15H2,1-4H3