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

Systemtic Name: butyl 1-(2-chloranyl-2-phenyl-ethyl)-4-pyrrolidin-1-yl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: butyl 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 butyl ester IUPAC Name: butyl 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 butyl ester Formula: C23H27ClN4O2 MolecularWeight: 426.93908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27ClN4O2/c1-2-3-13-30-23(29)19-14-25-22-18(21(19)27-11-7-8-12-27)15-26-28(22)16-20(24)17-9-5-4-6-10-17/h4-6,9-10,14-15,20H,2-3,7-8,11-13,16H2,1H3