diethyl 2-(2-bromoethyl)-2-[(E)-4-oxidanylidenepent-2-enyl]propanedioate

Systemtic Name: diethyl 2-(2-bromoethyl)-2-[(E)-4-oxidanylidenepent-2-enyl]propanedioate Openeye Name: diethyl 2-(2-bromoethyl)-2-[(E)-4-oxopent-2-enyl]propanedioate CAS Name: 2-(2-bromoethyl)-2-[(E)-4-oxopent-2-enyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-(2-bromoethyl)-2-[(E)-4-oxopent-2-enyl]propanedioate Traditional Name: 2-(2-bromoethyl)-2-[(E)-4-ketopent-2-enyl]malonic acid diethyl ester Formula: C14H21BrO5 MolecularWeight: 349.21754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C(CCBr)(C/C=C/C(=O)C)C(=O)OCC

InChI

InChI=1S/C14H21BrO5/c1-4-19-12(17)14(9-10-15,13(18)20-5-2)8-6-7-11(3)16/h6-7H,4-5,8-10H2,1-3H3/b7-6+