[3-[ethoxy(propylsulfanyl)phosphoryl]sulfanylphenyl] benzenesulfonate

Systemtic Name: [3-[ethoxy(propylsulfanyl)phosphoryl]sulfanylphenyl] benzenesulfonate Openeye Name: [3-[ethoxy(propylsulfanyl)phosphoryl]sulfanylphenyl] benzenesulfonate CAS Name: benzenesulfonic acid [3-[[ethoxy-(propylthio)phosphoryl]thio]phenyl] ester IUPAC Name: [3-[ethoxy(propylsulfanyl)phosphoryl]sulfanylphenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [3-[[ethoxy-(propylthio)phosphoryl]thio]phenyl] ester Formula: C17H21O5PS3 MolecularWeight: 432.514401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSP(=O)(OCC)SC1=CC=CC(=C1)OS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCSP(=O)(OCC)SC1=CC=CC(=C1)OS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H21O5PS3/c1-3-13-24-23(18,21-4-2)25-16-10-8-9-15(14-16)22-26(19,20)17-11-6-5-7-12-17/h5-12,14H,3-4,13H2,1-2H3