tert-butyl 4-bromanyl-2,3-bis(oxidanylidene)indole-1-carboxylate

Systemtic Name: tert-butyl 4-bromanyl-2,3-bis(oxidanylidene)indole-1-carboxylate Openeye Name: tert-butyl 4-bromo-2,3-dioxo-indoline-1-carboxylate CAS Name: 4-bromo-2,3-dioxo-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-bromo-2,3-dioxoindole-1-carboxylate Traditional Name: 4-bromo-2,3-diketo-indoline-1-carboxylic acid tert-butyl ester Formula: C13H12BrNO4 MolecularWeight: 326.14268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C(=CC=C2)Br)C(=O)C1=O

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C(=CC=C2)Br)C(=O)C1=O

InChI

InChI=1S/C13H12BrNO4/c1-13(2,3)19-12(18)15-8-6-4-5-7(14)9(8)10(16)11(15)17/h4-6H,1-3H3