(3-bromophenyl) 3,4-dimethylbenzenesulfonate

Systemtic Name: (3-bromophenyl) 3,4-dimethylbenzenesulfonate Openeye Name: (3-bromophenyl) 3,4-dimethylbenzenesulfonate CAS Name: 3,4-dimethylbenzenesulfonic acid (3-bromophenyl) ester IUPAC Name: (3-bromophenyl) 3,4-dimethylbenzenesulfonate Traditional Name: 3,4-dimethylbenzenesulfonic acid (3-bromophenyl) ester Formula: C14H13BrO3S MolecularWeight: 341.22022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)OC2=CC(=CC=C2)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)OC2=CC(=CC=C2)Br)C

InChI

InChI=1S/C14H13BrO3S/c1-10-6-7-14(8-11(10)2)19(16,17)18-13-5-3-4-12(15)9-13/h3-9H,1-2H3