(2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 6-cyclopropyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: (2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 6-cyclopropyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: (2-methoxy-2-oxo-1-phenyl-ethyl) 6-cyclopropyl-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 6-cyclopropyl-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinecarboxylic acid (2-methoxy-2-oxo-1-phenylethyl) ester IUPAC Name: (2-methoxy-2-oxo-1-phenylethyl) 6-cyclopropyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 6-cyclopropyl-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid (2-keto-2-methoxy-1-phenyl-ethyl) ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3CC3)C(=O)OC(C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3CC3)C(=O)OC(C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C22H23N3O4/c1-13(2)25-20-17(12-23-25)16(11-18(24-20)14-9-10-14)21(26)29-19(22(27)28-3)15-7-5-4-6-8-15/h4-8,11-14,19H,9-10H2,1-3H3