tert-butyl 3-bromanylpyrrolo[2,3-b]pyridine-1-carboxylate

Systemtic Name: tert-butyl 3-bromanylpyrrolo[2,3-b]pyridine-1-carboxylate Openeye Name: tert-butyl 3-bromopyrrolo[2,3-b]pyridine-1-carboxylate CAS Name: 3-bromo-1-pyrrolo[2,3-b]pyridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-bromopyrrolo[2,3-b]pyridine-1-carboxylate Traditional Name: 3-bromopyrrolo[2,3-b]pyridine-1-carboxylic acid tert-butyl ester Formula: C12H13BrN2O2 MolecularWeight: 297.14782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=C1N=CC=C2)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=C1N=CC=C2)Br

InChI

InChI=1S/C12H13BrN2O2/c1-12(2,3)17-11(16)15-7-9(13)8-5-4-6-14-10(8)15/h4-7H,1-3H3