tert-butyl 4-[[4-azanyl-3-(4-azanyl-3-methoxy-phenyl)pyrazolo[3,4-d]pyrimidin-1-yl]methyl]-4-oxidanyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[4-azanyl-3-(4-azanyl-3-methoxy-phenyl)pyrazolo[3,4-d]pyrimidin-1-yl]methyl]-4-oxidanyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[4-amino-3-(4-amino-3-methoxy-phenyl)pyrazolo[3,4-d]pyrimidin-1-yl]methyl]-4-hydroxy-piperidine-1-carboxylate CAS Name: 4-[[4-amino-3-(4-amino-3-methoxyphenyl)-1-pyrazolo[3,4-d]pyrimidinyl]methyl]-4-hydroxy-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[4-amino-3-(4-amino-3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]methyl]-4-hydroxypiperidine-1-carboxylate Traditional Name: 4-[[4-amino-3-(4-amino-3-methoxy-phenyl)pyrazolo[3,4-d]pyrimidin-1-yl]methyl]-4-hydroxy-piperidine-1-carboxylic acid tert-butyl ester Formula: C23H31N7O4 MolecularWeight: 469.53674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)(CN2C3=C(C(=N2)C4=CC(=C(C=C4)N)OC)C(=NC=N3)N)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)(CN2C3=C(C(=N2)C4=CC(=C(C=C4)N)OC)C(=NC=N3)N)O

InChI

InChI=1S/C23H31N7O4/c1-22(2,3)34-21(31)29-9-7-23(32,8-10-29)12-30-20-17(19(25)26-13-27-20)18(28-30)14-5-6-15(24)16(11-14)33-4/h5-6,11,13,32H,7-10,12,24H2,1-4H3,(H2,25,26,27)