diethyl 2-[(E)-4-bromanylbut-2-enyl]-2-(3-oxidanylidenepropyl)propanedioate

Systemtic Name: diethyl 2-[(E)-4-bromanylbut-2-enyl]-2-(3-oxidanylidenepropyl)propanedioate Openeye Name: diethyl 2-[(E)-4-bromobut-2-enyl]-2-(3-oxopropyl)propanedioate CAS Name: 2-[(E)-4-bromobut-2-enyl]-2-(3-oxopropyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(E)-4-bromobut-2-enyl]-2-(3-oxopropyl)propanedioate Traditional Name: 2-[(E)-4-bromobut-2-enyl]-2-(3-ketopropyl)malonic acid diethyl ester Formula: C14H21BrO5 MolecularWeight: 349.21754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC=O)(CC=CCBr)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CCC=O)(C/C=C/CBr)C(=O)OCC

InChI

InChI=1S/C14H21BrO5/c1-3-19-12(17)14(9-7-11-16,8-5-6-10-15)13(18)20-4-2/h5-6,11H,3-4,7-10H2,1-2H3/b6-5+