7-[3-(4-bromanylphenoxy)-2-oxidanyl-propyl]-1,3,4-trimethyl-pyrazolo[3,4-b]pyridin-6-one

Systemtic Name: 7-[3-(4-bromanylphenoxy)-2-oxidanyl-propyl]-1,3,4-trimethyl-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 7-[3-(4-bromophenoxy)-2-hydroxy-propyl]-1,3,4-trimethyl-pyrazolo[3,4-b]pyridin-6-one CAS Name: 7-[3-(4-bromophenoxy)-2-hydroxypropyl]-1,3,4-trimethyl-6-pyrazolo[3,4-b]pyridinone IUPAC Name: 7-[3-(4-bromophenoxy)-2-hydroxypropyl]-1,3,4-trimethylpyrazolo[3,4-b]pyridin-6-one Traditional Name: 7-[3-(4-bromophenoxy)-2-hydroxy-propyl]-1,3,4-trimethyl-pyrazolo[3,4-b]pyridin-6-one Formula: C18H20BrN3O3 MolecularWeight: 406.2737

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C2=C1C(=NN2C)C)CC(COC3=CC=C(C=C3)Br)O

Isomeric SMILES

CC1=CC(=O)N(C2=C1C(=NN2C)C)CC(COC3=CC=C(C=C3)Br)O

InChI

InChI=1S/C18H20BrN3O3/c1-11-8-16(24)22(18-17(11)12(2)20-21(18)3)9-14(23)10-25-15-6-4-13(19)5-7-15/h4-8,14,23H,9-10H2,1-3H3