[3-[ethoxy(propylsulfanyl)phosphoryl]oxy-2,5-dimethyl-phenyl] benzenesulfonate

Systemtic Name: [3-[ethoxy(propylsulfanyl)phosphoryl]oxy-2,5-dimethyl-phenyl] benzenesulfonate Openeye Name: [3-[ethoxy(propylsulfanyl)phosphoryl]oxy-2,5-dimethyl-phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [3-[ethoxy-(propylthio)phosphoryl]oxy-2,5-dimethylphenyl] ester IUPAC Name: [3-[ethoxy(propylsulfanyl)phosphoryl]oxy-2,5-dimethylphenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [3-[ethoxy-(propylthio)phosphoryl]oxy-2,5-dimethyl-phenyl] ester Formula: C19H25O6PS2 MolecularWeight: 444.501961

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Descriptors Computed from Structure

Canonical SMILES:

CCCSP(=O)(OCC)OC1=C(C(=CC(=C1)C)OS(=O)(=O)C2=CC=CC=C2)C

Isomeric SMILES

CCCSP(=O)(OCC)OC1=C(C(=CC(=C1)C)OS(=O)(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C19H25O6PS2/c1-5-12-27-26(20,23-6-2)24-18-13-15(3)14-19(16(18)4)25-28(21,22)17-10-8-7-9-11-17/h7-11,13-14H,5-6,12H2,1-4H3