[2-(3,4-dichlorophenyl)-2-oxidanyl-ethyl] 4-methylbenzenesulfonate

Systemtic Name: [2-(3,4-dichlorophenyl)-2-oxidanyl-ethyl] 4-methylbenzenesulfonate Openeye Name: [2-(3,4-dichlorophenyl)-2-hydroxy-ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-(3,4-dichlorophenyl)-2-hydroxyethyl] ester IUPAC Name: [2-(3,4-dichlorophenyl)-2-hydroxyethyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(3,4-dichlorophenyl)-2-hydroxy-ethyl] ester Formula: C15H14Cl2O4S MolecularWeight: 361.24026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C2=CC(=C(C=C2)Cl)Cl)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(C2=CC(=C(C=C2)Cl)Cl)O

InChI

InChI=1S/C15H14Cl2O4S/c1-10-2-5-12(6-3-10)22(19,20)21-9-15(18)11-4-7-13(16)14(17)8-11/h2-8,15,18H,9H2,1H3