dimethyl 2-[(4-bromophenyl)methyl]propanedioate

Systemtic Name: dimethyl 2-[(4-bromophenyl)methyl]propanedioate Openeye Name: dimethyl 2-[(4-bromophenyl)methyl]propanedioate CAS Name: 2-[(4-bromophenyl)methyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(4-bromophenyl)methyl]propanedioate Traditional Name: 2-(4-bromobenzyl)malonic acid dimethyl ester Formula: C12H13BrO4 MolecularWeight: 301.13322

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)Br)C(=O)OC

Isomeric SMILES

COC(=O)C(CC1=CC=C(C=C1)Br)C(=O)OC

InChI

InChI=1S/C12H13BrO4/c1-16-11(14)10(12(15)17-2)7-8-3-5-9(13)6-4-8/h3-6,10H,7H2,1-2H3