4-[3-(bromomethyl)phenyl]butanoic acid

Systemtic Name: 4-[3-(bromomethyl)phenyl]butanoic acid Openeye Name: 4-[3-(bromomethyl)phenyl]butanoic acid CAS Name: 4-[3-(bromomethyl)phenyl]butanoic acid IUPAC Name: 4-[3-(bromomethyl)phenyl]butanoic acid Traditional Name: 4-[3-(bromomethyl)phenyl]butyric acid Formula: C11H13BrO2 MolecularWeight: 257.12372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CBr)CCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)CBr)CCCC(=O)O

InChI

InChI=1S/C11H13BrO2/c12-8-10-5-1-3-9(7-10)4-2-6-11(13)14/h1,3,5,7H,2,4,6,8H2,(H,13,14)