(2-bromanyl-4-methoxy-phenyl) 4-methylbenzenesulfonate

Systemtic Name: (2-bromanyl-4-methoxy-phenyl) 4-methylbenzenesulfonate Openeye Name: (2-bromo-4-methoxy-phenyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-bromo-4-methoxyphenyl) ester IUPAC Name: (2-bromo-4-methoxyphenyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-bromo-4-methoxy-phenyl) ester Formula: C14H13BrO4S MolecularWeight: 357.21962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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