5-bromanyl-4-oxidanylidene-2-phenyl-hexanoic acid

Systemtic Name: 5-bromanyl-4-oxidanylidene-2-phenyl-hexanoic acid Openeye Name: 5-bromo-4-oxo-2-phenyl-hexanoic acid CAS Name: 5-bromo-4-oxo-2-phenylhexanoic acid IUPAC Name: 5-bromo-4-oxo-2-phenylhexanoic acid Traditional Name: 5-bromo-4-keto-2-phenyl-hexanoic acid Formula: C12H13BrO3 MolecularWeight: 285.13382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13BrO3/c1-8(13)11(14)7-10(12(15)16)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3,(H,15,16)