4-(4-bromanyl-2-tert-butyl-phenoxy)butanoic acid

Systemtic Name: 4-(4-bromanyl-2-tert-butyl-phenoxy)butanoic acid Openeye Name: 4-(4-bromo-2-tert-butyl-phenoxy)butanoic acid CAS Name: 4-(4-bromo-2-tert-butylphenoxy)butanoic acid IUPAC Name: 4-(4-bromo-2-tert-butylphenoxy)butanoic acid Traditional Name: 4-(4-bromo-2-tert-butyl-phenoxy)butyric acid Formula: C14H19BrO3 MolecularWeight: 315.20286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19BrO3/c1-14(2,3)11-9-10(15)6-7-12(11)18-8-4-5-13(16)17/h6-7,9H,4-5,8H2,1-3H3,(H,16,17)