ethyl 1-(2-chloranyl-2-phenyl-ethyl)-4-piperidin-1-yl-pyrazolo[3,4-b]pyridine-5-carboxylate hydrochloride

Systemtic Name: ethyl 1-(2-chloranyl-2-phenyl-ethyl)-4-piperidin-1-yl-pyrazolo[3,4-b]pyridine-5-carboxylate hydrochloride Openeye Name: ethyl 1-(2-chloro-2-phenyl-ethyl)-4-(1-piperidyl)pyrazolo[3,4-b]pyridine-5-carboxylate hydrochloride CAS Name: 1-(2-chloro-2-phenylethyl)-4-(1-piperidinyl)-5-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 1-(2-chloro-2-phenylethyl)-4-piperidin-1-ylpyrazolo[3,4-b]pyridine-5-carboxylate hydrochloride Traditional Name: 1-(2-chloro-2-phenyl-ethyl)-4-piperidino-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester hydrochloride Formula: C22H26Cl2N4O2 MolecularWeight: 449.37344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1N3CCCCC3)C=NN2CC(C4=CC=CC=C4)Cl.Cl

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1N3CCCCC3)C=NN2CC(C4=CC=CC=C4)Cl.Cl

InChI

InChI=1S/C22H25ClN4O2.ClH/c1-2-29-22(28)18-13-24-21-17(20(18)26-11-7-4-8-12-26)14-25-27(21)15-19(23)16-9-5-3-6-10-16;/h3,5-6,9-10,13-14,19H,2,4,7-8,11-12,15H2,1H3;1H