(4-bromanyl-2-chloranyl-6-methyl-phenyl) 2-ethylsulfonylbenzoate

Systemtic Name: (4-bromanyl-2-chloranyl-6-methyl-phenyl) 2-ethylsulfonylbenzoate Openeye Name: (4-bromo-2-chloro-6-methyl-phenyl) 2-ethylsulfonylbenzoate CAS Name: 2-ethylsulfonylbenzoic acid (4-bromo-2-chloro-6-methylphenyl) ester IUPAC Name: (4-bromo-2-chloro-6-methylphenyl) 2-ethylsulfonylbenzoate Traditional Name: 2-esylbenzoic acid (4-bromo-2-chloro-6-methyl-phenyl) ester Formula: C16H14BrClO4S MolecularWeight: 417.70196

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)OC2=C(C=C(C=C2C)Br)Cl

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)OC2=C(C=C(C=C2C)Br)Cl

InChI

InChI=1S/C16H14BrClO4S/c1-3-23(20,21)14-7-5-4-6-12(14)16(19)22-15-10(2)8-11(17)9-13(15)18/h4-9H,3H2,1-2H3