4-(4-bromanyl-2-tert-butyl-5-methyl-phenoxy)butanoate

Systemtic Name: 4-(4-bromanyl-2-tert-butyl-5-methyl-phenoxy)butanoate Openeye Name: 4-(4-bromo-2-tert-butyl-5-methyl-phenoxy)butanoate CAS Name: 4-(4-bromo-2-tert-butyl-5-methylphenoxy)butanoate IUPAC Name: 4-(4-bromo-2-tert-butyl-5-methylphenoxy)butanoate Traditional Name: 4-(4-bromo-2-tert-butyl-5-methyl-phenoxy)butyrate Formula: C15H20BrO3- MolecularWeight: 328.2215

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)(C)C)OCCCC(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)(C)C)OCCCC(=O)[O-]

InChI

InChI=1S/C15H21BrO3/c1-10-8-13(19-7-5-6-14(17)18)11(9-12(10)16)15(2,3)4/h8-9H,5-7H2,1-4H3,(H,17,18)/p-1