dimethyl 2-(2-bromanylprop-2-enyl)-2-oct-7-en-2-ynyl-propanedioate

Systemtic Name: dimethyl 2-(2-bromanylprop-2-enyl)-2-oct-7-en-2-ynyl-propanedioate Openeye Name: dimethyl 2-(2-bromoallyl)-2-oct-7-en-2-ynyl-propanedioate CAS Name: 2-(2-bromoprop-2-enyl)-2-oct-7-en-2-ynylpropanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(2-bromoprop-2-enyl)-2-oct-7-en-2-ynylpropanedioate Traditional Name: 2-(2-bromoallyl)-2-oct-7-en-2-ynyl-malonic acid dimethyl ester Formula: C16H21BrO4 MolecularWeight: 357.23954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC#CCCCC=C)(CC(=C)Br)C(=O)OC

Isomeric SMILES

COC(=O)C(CC#CCCCC=C)(CC(=C)Br)C(=O)OC

InChI

InChI=1S/C16H21BrO4/c1-5-6-7-8-9-10-11-16(12-13(2)17,14(18)20-3)15(19)21-4/h5H,1-2,6-8,11-12H2,3-4H3