(3-bromophenyl) 4-methoxy-3-methyl-benzenesulfonate

Systemtic Name: (3-bromophenyl) 4-methoxy-3-methyl-benzenesulfonate Openeye Name: (3-bromophenyl) 4-methoxy-3-methyl-benzenesulfonate CAS Name: 4-methoxy-3-methylbenzenesulfonic acid (3-bromophenyl) ester IUPAC Name: (3-bromophenyl) 4-methoxy-3-methylbenzenesulfonate Traditional Name: 4-methoxy-3-methyl-benzenesulfonic acid (3-bromophenyl) ester Formula: C14H13BrO4S MolecularWeight: 357.21962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13BrO4S/c1-10-8-13(6-7-14(10)18-2)20(16,17)19-12-5-3-4-11(15)9-12/h3-9H,1-2H3