4-(2-bromanyl-6-tert-butyl-4-ethyl-phenoxy)butanoic acid

Systemtic Name: 4-(2-bromanyl-6-tert-butyl-4-ethyl-phenoxy)butanoic acid Openeye Name: 4-(2-bromo-6-tert-butyl-4-ethyl-phenoxy)butanoic acid CAS Name: 4-(2-bromo-6-tert-butyl-4-ethylphenoxy)butanoic acid IUPAC Name: 4-(2-bromo-6-tert-butyl-4-ethylphenoxy)butanoic acid Traditional Name: 4-(2-bromo-6-tert-butyl-4-ethyl-phenoxy)butyric acid Formula: C16H23BrO3 MolecularWeight: 343.25602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1)Br)OCCCC(=O)O)C(C)(C)C

Isomeric SMILES

CCC1=CC(=C(C(=C1)Br)OCCCC(=O)O)C(C)(C)C

InChI

InChI=1S/C16H23BrO3/c1-5-11-9-12(16(2,3)4)15(13(17)10-11)20-8-6-7-14(18)19/h9-10H,5-8H2,1-4H3,(H,18,19)