diethyl 2-[[4-(2-bromanylethanoyl)phenyl]methyl]propanedioate

Systemtic Name: diethyl 2-[[4-(2-bromanylethanoyl)phenyl]methyl]propanedioate Openeye Name: diethyl 2-[[4-(2-bromoacetyl)phenyl]methyl]propanedioate CAS Name: 2-[[4-(2-bromo-1-oxoethyl)phenyl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4-(2-bromoacetyl)phenyl]methyl]propanedioate Traditional Name: 2-[4-(2-bromoacetyl)benzyl]malonic acid diethyl ester Formula: C16H19BrO5 MolecularWeight: 371.22306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)C(=O)CBr)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)C(=O)CBr)C(=O)OCC

InChI

InChI=1S/C16H19BrO5/c1-3-21-15(19)13(16(20)22-4-2)9-11-5-7-12(8-6-11)14(18)10-17/h5-8,13H,3-4,9-10H2,1-2H3