2,6-ditert-butyl-4-[1-(2-oxidanylpropyl)-2H-pyrazolo[3,4-b]pyridin-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 2,6-ditert-butyl-4-[1-(2-oxidanylpropyl)-2H-pyrazolo[3,4-b]pyridin-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 2,6-ditert-butyl-4-[1-(2-hydroxypropyl)-2H-pyrazolo[3,4-b]pyridin-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 2,6-ditert-butyl-4-[1-(2-hydroxypropyl)-2H-pyrazolo[3,4-b]pyridin-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 2,6-ditert-butyl-4-[1-(2-hydroxypropyl)-2H-pyrazolo[3,4-b]pyridin-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 2,6-ditert-butyl-4-[1-(2-hydroxypropyl)-2H-pyrazolo[3,4-b]pyridin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C23H31N3O2 MolecularWeight: 381.51114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C2=C(C=CC=N2)C(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)N1)O

Isomeric SMILES

CC(CN1C2=C(C=CC=N2)C(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)N1)O

InChI

InChI=1S/C23H31N3O2/c1-14(27)13-26-21-16(9-8-10-24-21)19(25-26)15-11-17(22(2,3)4)20(28)18(12-15)23(5,6)7/h8-12,14,25,27H,13H2,1-7H3