methyl 6-(2-bromophenyl)-6-oxidanylidene-hexanoate

Systemtic Name: methyl 6-(2-bromophenyl)-6-oxidanylidene-hexanoate Openeye Name: methyl 6-(2-bromophenyl)-6-oxo-hexanoate CAS Name: 6-(2-bromophenyl)-6-oxohexanoic acid methyl ester IUPAC Name: methyl 6-(2-bromophenyl)-6-oxohexanoate Traditional Name: 6-(2-bromophenyl)-6-keto-hexanoic acid methyl ester Formula: C13H15BrO3 MolecularWeight: 299.1604

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC(=O)C1=CC=CC=C1Br

Isomeric SMILES

COC(=O)CCCCC(=O)C1=CC=CC=C1Br

InChI

InChI=1S/C13H15BrO3/c1-17-13(16)9-5-4-8-12(15)10-6-2-3-7-11(10)14/h2-3,6-7H,4-5,8-9H2,1H3