tert-butyl 3-bromanyl-5-oxidanylidene-2H-pyrrole-1-carboxylate

Systemtic Name: tert-butyl 3-bromanyl-5-oxidanylidene-2H-pyrrole-1-carboxylate Openeye Name: tert-butyl 3-bromo-5-oxo-2H-pyrrole-1-carboxylate CAS Name: 3-bromo-5-oxo-2H-pyrrole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-bromo-5-oxo-2H-pyrrole-1-carboxylate Traditional Name: 4-bromo-2-keto-3-pyrroline-1-carboxylic acid tert-butyl ester Formula: C9H12BrNO3 MolecularWeight: 262.10048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(=CC1=O)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(=CC1=O)Br

InChI

InChI=1S/C9H12BrNO3/c1-9(2,3)14-8(13)11-5-6(10)4-7(11)12/h4H,5H2,1-3H3