[6-chloranyl-3-[ethoxy(propylsulfanyl)phosphoryl]sulfanyl-2,4-dimethyl-phenyl] benzenesulfonate

Systemtic Name: [6-chloranyl-3-[ethoxy(propylsulfanyl)phosphoryl]sulfanyl-2,4-dimethyl-phenyl] benzenesulfonate Openeye Name: [6-chloro-3-[ethoxy(propylsulfanyl)phosphoryl]sulfanyl-2,4-dimethyl-phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [6-chloro-3-[[ethoxy-(propylthio)phosphoryl]thio]-2,4-dimethylphenyl] ester IUPAC Name: [6-chloro-3-[ethoxy(propylsulfanyl)phosphoryl]sulfanyl-2,4-dimethylphenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [6-chloro-3-[[ethoxy-(propylthio)phosphoryl]thio]-2,4-dimethyl-phenyl] ester Formula: C19H24ClO5PS3 MolecularWeight: 495.012621

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Descriptors Computed from Structure

Canonical SMILES:

CCCSP(=O)(OCC)SC1=C(C(=C(C=C1C)Cl)OS(=O)(=O)C2=CC=CC=C2)C

Isomeric SMILES

CCCSP(=O)(OCC)SC1=C(C(=C(C=C1C)Cl)OS(=O)(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C19H24ClO5PS3/c1-5-12-27-26(21,24-6-2)28-19-14(3)13-17(20)18(15(19)4)25-29(22,23)16-10-8-7-9-11-16/h7-11,13H,5-6,12H2,1-4H3