(2-bromanyl-4-tert-butyl-6-chloranyl-phenyl) 4-methylbenzenesulfonate

Systemtic Name: (2-bromanyl-4-tert-butyl-6-chloranyl-phenyl) 4-methylbenzenesulfonate Openeye Name: (2-bromo-4-tert-butyl-6-chloro-phenyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-bromo-4-tert-butyl-6-chlorophenyl) ester IUPAC Name: (2-bromo-4-tert-butyl-6-chlorophenyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-bromo-4-tert-butyl-6-chloro-phenyl) ester Formula: C17H18BrClO3S MolecularWeight: 417.74502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)C(C)(C)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)C(C)(C)C)Cl

InChI

InChI=1S/C17H18BrClO3S/c1-11-5-7-13(8-6-11)23(20,21)22-16-14(18)9-12(10-15(16)19)17(2,3)4/h5-10H,1-4H3