(4-phenylmethoxyphenyl) 4-chloranyl-3-methoxy-benzenesulfonate

Systemtic Name: (4-phenylmethoxyphenyl) 4-chloranyl-3-methoxy-benzenesulfonate Openeye Name: (4-benzyloxyphenyl) 4-chloro-3-methoxy-benzenesulfonate CAS Name: 4-chloro-3-methoxybenzenesulfonic acid (4-phenylmethoxyphenyl) ester IUPAC Name: (4-phenylmethoxyphenyl) 4-chloro-3-methoxybenzenesulfonate Traditional Name: 4-chloro-3-methoxy-benzenesulfonic acid (4-benzoxyphenyl) ester Formula: C20H17ClO5S MolecularWeight: 404.86398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)S(=O)(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)S(=O)(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3)Cl

InChI

InChI=1S/C20H17ClO5S/c1-24-20-13-18(11-12-19(20)21)27(22,23)26-17-9-7-16(8-10-17)25-14-15-5-3-2-4-6-15/h2-13H,14H2,1H3