[2-(2,4-dichlorophenyl)-2,2-dimethoxy-ethyl] 2-(1H-imidazol-5-ylmethyl)benzenesulfonate

Systemtic Name: [2-(2,4-dichlorophenyl)-2,2-dimethoxy-ethyl] 2-(1H-imidazol-5-ylmethyl)benzenesulfonate Openeye Name: [2-(2,4-dichlorophenyl)-2,2-dimethoxy-ethyl] 2-(1H-imidazol-5-ylmethyl)benzenesulfonate CAS Name: 2-(1H-imidazol-5-ylmethyl)benzenesulfonic acid [2-(2,4-dichlorophenyl)-2,2-dimethoxyethyl] ester IUPAC Name: [2-(2,4-dichlorophenyl)-2,2-dimethoxyethyl] 2-(1H-imidazol-5-ylmethyl)benzenesulfonate Traditional Name: 2-(1H-imidazol-5-ylmethyl)benzenesulfonic acid [2-(2,4-dichlorophenyl)-2,2-dimethoxy-ethyl] ester Formula: C20H20Cl2N2O5S MolecularWeight: 471.3542

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Descriptors Computed from Structure

Canonical SMILES:

COC(COS(=O)(=O)C1=CC=CC=C1CC2=CN=CN2)(C3=C(C=C(C=C3)Cl)Cl)OC

Isomeric SMILES

COC(COS(=O)(=O)C1=CC=CC=C1CC2=CN=CN2)(C3=C(C=C(C=C3)Cl)Cl)OC

InChI

InChI=1S/C20H20Cl2N2O5S/c1-27-20(28-2,17-8-7-15(21)10-18(17)22)12-29-30(25,26)19-6-4-3-5-14(19)9-16-11-23-13-24-16/h3-8,10-11,13H,9,12H2,1-2H3,(H,23,24)