2,6-ditert-butyl-4-[3-(1H-pyrazolo[3,4-b]pyridin-4-yl)propyl]phenol

Systemtic Name: 2,6-ditert-butyl-4-[3-(1H-pyrazolo[3,4-b]pyridin-4-yl)propyl]phenol Openeye Name: 2,6-ditert-butyl-4-[3-(1H-pyrazolo[3,4-b]pyridin-4-yl)propyl]phenol CAS Name: 2,6-ditert-butyl-4-[3-(1H-pyrazolo[3,4-b]pyridin-4-yl)propyl]phenol IUPAC Name: 2,6-ditert-butyl-4-[3-(1H-pyrazolo[3,4-b]pyridin-4-yl)propyl]phenol Traditional Name: 2,6-ditert-butyl-4-[3-(1H-pyrazolo[3,4-b]pyridin-4-yl)propyl]phenol Formula: C23H31N3O MolecularWeight: 365.51174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCC2=C3C=NNC3=NC=C2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCC2=C3C=NNC3=NC=C2

InChI

InChI=1S/C23H31N3O/c1-22(2,3)18-12-15(13-19(20(18)27)23(4,5)6)8-7-9-16-10-11-24-21-17(16)14-25-26-21/h10-14,27H,7-9H2,1-6H3,(H,24,25,26)