3-[2-(6-bromanylhexyl)phenyl]butanoic acid

Systemtic Name: 3-[2-(6-bromanylhexyl)phenyl]butanoic acid Openeye Name: 3-[2-(6-bromohexyl)phenyl]butanoic acid CAS Name: 3-[2-(6-bromohexyl)phenyl]butanoic acid IUPAC Name: 3-[2-(6-bromohexyl)phenyl]butanoic acid Traditional Name: 3-[2-(6-bromohexyl)phenyl]butyric acid Formula: C16H23BrO2 MolecularWeight: 327.25662

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)C1=CC=CC=C1CCCCCCBr

Isomeric SMILES

CC(CC(=O)O)C1=CC=CC=C1CCCCCCBr

InChI

InChI=1S/C16H23BrO2/c1-13(12-16(18)19)15-10-6-5-9-14(15)8-4-2-3-7-11-17/h5-6,9-10,13H,2-4,7-8,11-12H2,1H3,(H,18,19)