methyl 5-(3-bromanyl-4-chloranyl-phenyl)-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-(3-bromanyl-4-chloranyl-phenyl)-5-oxidanylidene-pentanoate Openeye Name: methyl 5-(3-bromo-4-chloro-phenyl)-5-oxo-pentanoate CAS Name: 5-(3-bromo-4-chlorophenyl)-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-(3-bromo-4-chlorophenyl)-5-oxopentanoate Traditional Name: 5-(3-bromo-4-chloro-phenyl)-5-keto-valeric acid methyl ester Formula: C12H12BrClO3 MolecularWeight: 319.57888

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)C1=CC(=C(C=C1)Cl)Br

Isomeric SMILES

COC(=O)CCCC(=O)C1=CC(=C(C=C1)Cl)Br

InChI

InChI=1S/C12H12BrClO3/c1-17-12(16)4-2-3-11(15)8-5-6-10(14)9(13)7-8/h5-7H,2-4H2,1H3