(2-bromanyl-6-methoxy-4-phenylmethoxy-phenyl) 4-methylbenzenesulfonate

Systemtic Name: (2-bromanyl-6-methoxy-4-phenylmethoxy-phenyl) 4-methylbenzenesulfonate Openeye Name: (4-benzyloxy-2-bromo-6-methoxy-phenyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-bromo-6-methoxy-4-phenylmethoxyphenyl) ester IUPAC Name: (2-bromo-6-methoxy-4-phenylmethoxyphenyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-benzoxy-2-bromo-6-methoxy-phenyl) ester Formula: C21H19BrO5S MolecularWeight: 463.34156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)OCC3=CC=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C21H19BrO5S/c1-15-8-10-18(11-9-15)28(23,24)27-21-19(22)12-17(13-20(21)25-2)26-14-16-6-4-3-5-7-16/h3-13H,14H2,1-2H3