3-bromanyl-3-(1-bromanylbutyl)-2-benzofuran-1-one

Systemtic Name: 3-bromanyl-3-(1-bromanylbutyl)-2-benzofuran-1-one Openeye Name: 3-bromo-3-(1-bromobutyl)isobenzofuran-1-one CAS Name: 3-bromo-3-(1-bromobutyl)-1-isobenzofuranone IUPAC Name: 3-bromo-3-(1-bromobutyl)-2-benzofuran-1-one Traditional Name: 3-bromo-3-(1-bromobutyl)phthalide Formula: C12H12Br2O2 MolecularWeight: 348.03048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1(C2=CC=CC=C2C(=O)O1)Br)Br

Isomeric SMILES

CCCC(C1(C2=CC=CC=C2C(=O)O1)Br)Br

InChI

InChI=1S/C12H12Br2O2/c1-2-5-10(13)12(14)9-7-4-3-6-8(9)11(15)16-12/h3-4,6-7,10H,2,5H2,1H3