dimethyl 2-(2-bromanylprop-2-enyl)-2-(7-oxidanylidenenon-8-en-2-ynyl)propanedioate

Systemtic Name: dimethyl 2-(2-bromanylprop-2-enyl)-2-(7-oxidanylidenenon-8-en-2-ynyl)propanedioate Openeye Name: dimethyl 2-(2-bromoallyl)-2-(7-oxonon-8-en-2-ynyl)propanedioate CAS Name: 2-(2-bromoprop-2-enyl)-2-(7-oxonon-8-en-2-ynyl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(2-bromoprop-2-enyl)-2-(7-oxonon-8-en-2-ynyl)propanedioate Traditional Name: 2-(2-bromoallyl)-2-(7-ketonon-8-en-2-ynyl)malonic acid dimethyl ester Formula: C17H21BrO5 MolecularWeight: 385.24964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21BrO5/c1-5-14(19)10-8-6-7-9-11-17(12-13(2)18,15(20)22-3)16(21)23-4/h5H,1-2,6,8,10-12H2,3-4H3