(2-tert-butyl-4-methyl-phenyl) 3-bromanyl-4-methyl-benzoate

Systemtic Name: (2-tert-butyl-4-methyl-phenyl) 3-bromanyl-4-methyl-benzoate Openeye Name: (2-tert-butyl-4-methyl-phenyl) 3-bromo-4-methyl-benzoate CAS Name: 3-bromo-4-methylbenzoic acid (2-tert-butyl-4-methylphenyl) ester IUPAC Name: (2-tert-butyl-4-methylphenyl) 3-bromo-4-methylbenzoate Traditional Name: 3-bromo-4-methyl-benzoic acid (2-tert-butyl-4-methyl-phenyl) ester Formula: C19H21BrO2 MolecularWeight: 361.27284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=CC(=C(C=C2)C)Br)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=CC(=C(C=C2)C)Br)C(C)(C)C

InChI

InChI=1S/C19H21BrO2/c1-12-6-9-17(15(10-12)19(3,4)5)22-18(21)14-8-7-13(2)16(20)11-14/h6-11H,1-5H3