methyl 4-bromanyl-2-tert-butyl-3-methoxy-benzoate

Systemtic Name: methyl 4-bromanyl-2-tert-butyl-3-methoxy-benzoate Openeye Name: methyl 4-bromo-2-tert-butyl-3-methoxy-benzoate CAS Name: 4-bromo-2-tert-butyl-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-bromo-2-tert-butyl-3-methoxybenzoate Traditional Name: 4-bromo-2-tert-butyl-3-methoxy-benzoic acid methyl ester Formula: C13H17BrO3 MolecularWeight: 301.17628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1OC)Br)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1OC)Br)C(=O)OC

InChI

InChI=1S/C13H17BrO3/c1-13(2,3)10-8(12(15)17-5)6-7-9(14)11(10)16-4/h6-7H,1-5H3