diethyl 2-(3-bromanylprop-1-en-2-yl)propanedioate; dimethylsulfanium

Systemtic Name: diethyl 2-(3-bromanylprop-1-en-2-yl)propanedioate; dimethylsulfanium Openeye Name: diethyl 2-[1-(bromomethyl)vinyl]propanedioate; dimethylsulfonium CAS Name: 2-(3-bromoprop-1-en-2-yl)propanedioic acid diethyl ester; dimethylsulfonium IUPAC Name: diethyl 2-(3-bromoprop-1-en-2-yl)propanedioate; dimethylsulfanium Traditional Name: 2-[1-(bromomethyl)vinyl]malonic acid diethyl ester; dimethylsulfonium Formula: C12H22BrO4S+ MolecularWeight: 342.26968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=C)CBr)C(=O)OCC.C[SH+]C

Isomeric SMILES

CCOC(=O)C(C(=C)CBr)C(=O)OCC.C[SH+]C

InChI

InChI=1S/C10H15BrO4.C2H6S/c1-4-14-9(12)8(7(3)6-11)10(13)15-5-2;1-3-2/h8H,3-6H2,1-2H3;1-2H3/p+1