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

Systemtic Name: propyl 1-(2-chloranyl-2-phenyl-ethyl)-4-pyrrolidin-1-yl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: propyl 1-(2-chloro-2-phenyl-ethyl)-4-pyrrolidin-1-yl-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-(2-chloro-2-phenylethyl)-4-(1-pyrrolidinyl)-5-pyrazolo[3,4-b]pyridinecarboxylic acid propyl ester IUPAC Name: propyl 1-(2-chloro-2-phenylethyl)-4-pyrrolidin-1-ylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-(2-chloro-2-phenyl-ethyl)-4-pyrrolidino-pyrazolo[3,4-b]pyridine-5-carboxylic acid propyl ester Formula: C22H25ClN4O2 MolecularWeight: 412.9125

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CN=C2C(=C1N3CCCC3)C=NN2CC(C4=CC=CC=C4)Cl

Isomeric SMILES

CCCOC(=O)C1=CN=C2C(=C1N3CCCC3)C=NN2CC(C4=CC=CC=C4)Cl

InChI

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