ethyl 4-chloranyl-1-(2-chloranyl-3-phenoxy-propyl)pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 4-chloranyl-1-(2-chloranyl-3-phenoxy-propyl)pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 4-chloro-1-(2-chloro-3-phenoxy-propyl)pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 4-chloro-1-(2-chloro-3-phenoxypropyl)-5-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-chloro-1-(2-chloro-3-phenoxypropyl)pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 4-chloro-1-(2-chloro-3-phenoxy-propyl)pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C18H17Cl2N3O3 MolecularWeight: 394.25188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1Cl)C=NN2CC(COC3=CC=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1Cl)C=NN2CC(COC3=CC=CC=C3)Cl

InChI

InChI=1S/C18H17Cl2N3O3/c1-2-25-18(24)15-8-21-17-14(16(15)20)9-22-23(17)10-12(19)11-26-13-6-4-3-5-7-13/h3-9,12H,2,10-11H2,1H3