(2,3,6-trimethylphenyl) 5-bromanyl-2-chloranyl-benzoate

Systemtic Name: (2,3,6-trimethylphenyl) 5-bromanyl-2-chloranyl-benzoate Openeye Name: (2,3,6-trimethylphenyl) 5-bromo-2-chloro-benzoate CAS Name: 5-bromo-2-chlorobenzoic acid (2,3,6-trimethylphenyl) ester IUPAC Name: (2,3,6-trimethylphenyl) 5-bromo-2-chlorobenzoate Traditional Name: 5-bromo-2-chloro-benzoic acid (2,3,6-trimethylphenyl) ester Formula: C16H14BrClO2 MolecularWeight: 353.63816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrClO2/c1-9-4-5-10(2)15(11(9)3)20-16(19)13-8-12(17)6-7-14(13)18/h4-8H,1-3H3