(4-phenylmethoxyphenyl) 5-chloranyl-2-methyl-benzenesulfonate

Systemtic Name: (4-phenylmethoxyphenyl) 5-chloranyl-2-methyl-benzenesulfonate Openeye Name: (4-benzyloxyphenyl) 5-chloro-2-methyl-benzenesulfonate CAS Name: 5-chloro-2-methylbenzenesulfonic acid (4-phenylmethoxyphenyl) ester IUPAC Name: (4-phenylmethoxyphenyl) 5-chloro-2-methylbenzenesulfonate Traditional Name: 5-chloro-2-methyl-benzenesulfonic acid (4-benzoxyphenyl) ester Formula: C20H17ClO4S MolecularWeight: 388.86458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)S(=O)(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)S(=O)(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C20H17ClO4S/c1-15-7-8-17(21)13-20(15)26(22,23)25-19-11-9-18(10-12-19)24-14-16-5-3-2-4-6-16/h2-13H,14H2,1H3