methyl 2,3-bis(bromanyl)-3-[4-(2-oxidanylidenepropyl)phenyl]propanoate

Systemtic Name: methyl 2,3-bis(bromanyl)-3-[4-(2-oxidanylidenepropyl)phenyl]propanoate Openeye Name: methyl 3-(4-acetonylphenyl)-2,3-dibromo-propanoate CAS Name: 2,3-dibromo-3-[4-(2-oxopropyl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 2,3-dibromo-3-[4-(2-oxopropyl)phenyl]propanoate Traditional Name: 3-(4-acetonylphenyl)-2,3-dibromo-propionic acid methyl ester Formula: C13H14Br2O3 MolecularWeight: 378.05646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14Br2O3/c1-8(16)7-9-3-5-10(6-4-9)11(14)12(15)13(17)18-2/h3-6,11-12H,7H2,1-2H3