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

Systemtic Name: methyl 4-[(3,4-dimethyl-6-oxidanylidene-1-phenyl-pyrazolo[3,4-b]pyridin-7-yl)methyl]benzoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C23H21N3O3 MolecularWeight: 387.43114

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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

Isomeric SMILES

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

InChI

InChI=1S/C23H21N3O3/c1-15-13-20(27)25(14-17-9-11-18(12-10-17)23(28)29-3)22-21(15)16(2)24-26(22)19-7-5-4-6-8-19/h4-13H,14H2,1-3H3