(2-propan-2-ylphenyl) 4-bromanyl-2,5-dimethyl-benzenesulfonate

Systemtic Name: (2-propan-2-ylphenyl) 4-bromanyl-2,5-dimethyl-benzenesulfonate Openeye Name: (2-isopropylphenyl) 4-bromo-2,5-dimethyl-benzenesulfonate CAS Name: 4-bromo-2,5-dimethylbenzenesulfonic acid (2-propan-2-ylphenyl) ester IUPAC Name: (2-propan-2-ylphenyl) 4-bromo-2,5-dimethylbenzenesulfonate Traditional Name: 4-bromo-2,5-dimethyl-benzenesulfonic acid o-cumenyl ester Formula: C17H19BrO3S MolecularWeight: 383.29996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)S(=O)(=O)OC2=CC=CC=C2C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)S(=O)(=O)OC2=CC=CC=C2C(C)C

InChI

InChI=1S/C17H19BrO3S/c1-11(2)14-7-5-6-8-16(14)21-22(19,20)17-10-12(3)15(18)9-13(17)4/h5-11H,1-4H3